CC1=C(SC(=N1)N)C(=O)NCC2=CC=CC=C2
CAS: 21709-39-7
Nom: 2-amino-N-benzyl-4-methyl-1,3-thiazole-5-carboxamide
SMILES: CC1=C(SC(=N1)N)C(=O)NCC2=CC=CC=C2

Molecular Processing

Molecular formula
C12H13N3OS
Molecular weight
247.32
Exact mass
247.0779
XLogP
1.96
TPSA
68.01
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
68.88

Supplementary Information

InChIKey: CZIFOKIOABZOAY-UHFFFAOYSA-N
Synonymes
21709-39-7DTXSID70944326N-Benzyl-2-imino-4-methyl-2,3-dihydro-1,3-thiazole-5-carboximidic acidRefChem:1091580DTXCID9013726732-Amino-4-methylthiazole-5-carboxylic Acid Benzylamide2-Amino-4-methyl-N-(phenylmethyl)-5-thiazolecarboxamide2-amino-N-benzyl-4-methylthiazole-5-carboxamideOprea1_092509SCHEMBL2448265-Thiazolecarboxamide, 2-amino-4-methyl-N-(phenylmethyl)-CZIFOKIOABZOAY-UHFFFAOYSA-NAKOS012088371DB-3135132-amino-4-methyl-thiazole-5-carboxylic acid benzylamide
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→