이름: 2-((pyridin-2-ylmethyl)(8-(3-(4-sulfamoylphenyl)thioureido)octyl)amino)acetic acid
IUPAC: 2-[pyridin-2-ylmethyl-[8-[(4-sulfamoylphenyl)carbamothioylamino]octyl]amino]acetic acid
SMILES:
NS(=O)(=O)c1ccc(NC(=S)NCCCCCCCCN(CC(=O)O)Cc2ccccn2)cc1Canonical SMILES:
C1=CC=NC(=C1)CN(CCCCCCCCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)CC(=O)O분자식: C23H33N5O4S2
분자량: 507.70
InChIKey: VRLQIYIAIKMDSG-UHFFFAOYSA-N
InChI:
PubChem CID: 46234261 →InChI=1S/C23H33N5O4S2/c24-34(31,32)21-12-10-19(11-13-21)27-23(33)26-15-6-3-1-2-4-8-16-28(18-22(29)30)17-20-9-5-7-14-25-20/h5,7,9-14H,1-4,6,8,15-18H2,(H,29,30)(H2,24,31,32)(H2,26,27,33)동의어
SCHEMBL2469928VRLQIYIAIKMDSG-UHFFFAOYSA-N2-((pyridin-2-ylmethyl)(8-(3-(4-sulfamoylphenyl)thioureido)octyl)amino)acetic acid
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