Nombre: product

IUPAC: 3-[(1,1-dioxo-2,3,4,5-tetrahydro-1lambda6,2,5-benzothiadiazepin-8-yl)oxy]benzonitrile

SMILES: N#Cc1cccc(Oc2ccc3c(c2)S(=O)(=O)NCCN3)c1

Canonical SMILES: C1CNS(=O)(=O)C2=C(N1)C=CC(=C2)OC3=CC=CC(=C3)C#N

Fórmula molecular: C15H13N3O3S

Masa molecular: 315.30

InChIKey: DPZJREPOHKTMEM-UHFFFAOYSA-N

InChI: InChI=1S/C15H13N3O3S/c16-10-11-2-1-3-12(8-11)21-13-4-5-14-15(9-13)22(19,20)18-7-6-17-14/h1-5,8-9,17-18H,6-7H2

Sinónimos

SCHEMBL2809179DPZJREPOHKTMEM-UHFFFAOYSA-N3-[(1,1-dioxido-2,3,4,5-tetrahydro-1,2,5-benzothiadiazepin-8-yl)oxy]-benzonitrile