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

Systemtic Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-[4-(benzylsulfamoyl)phenyl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-[4-[(phenylmethyl)sulfamoyl]phenyl]-2-[(6-phenyl-4-pyrimidinyl)thio]butanamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-2-(6-phenylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C27H26N4O3S2 MolecularWeight: 518.65034

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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)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC=NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S2/c1-2-25(35-26-17-24(28-19-29-26)21-11-7-4-8-12-21)27(32)31-22-13-15-23(16-14-22)36(33,34)30-18-20-9-5-3-6-10-20/h3-17,19,25,30H,2,18H2,1H3,(H,31,32)