2-(6-methylpyrimidin-4-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-(6-methylpyrimidin-4-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide Openeye Name: N-[4-(benzylsulfamoyl)phenyl]-2-(6-methylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: 2-[(6-methyl-4-pyrimidinyl)thio]-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-2-(6-methylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(6-methylpyrimidin-4-yl)thio]butyramide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC=NC(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC=NC(=C3)C

InChI

InChI=1S/C22H24N4O3S2/c1-3-20(30-21-13-16(2)23-15-24-21)22(27)26-18-9-11-19(12-10-18)31(28,29)25-14-17-7-5-4-6-8-17/h4-13,15,20,25H,3,14H2,1-2H3,(H,26,27)