4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-thiazol-2-yl]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-2-thiazolyl]benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-phenylphenyl)-5-propyl-thiazol-2-yl]benzamide Formula: C31H29N5O3S2 MolecularWeight: 583.72366

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CCC#N)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CCC#N)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H29N5O3S2/c1-2-8-28-29(25-13-11-24(12-14-25)23-9-4-3-5-10-23)34-31(40-28)35-30(37)26-15-17-27(18-16-26)41(38,39)36(21-6-19-32)22-7-20-33/h3-5,9-18H,2,6-8,21-22H2,1H3,(H,34,35,37)