N-[3-[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-3-methyl-benzamide

Systemtic Name: N-[3-[1-[(4-acetamidophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-3-methyl-benzamide Openeye Name: N-[3-[1-[(4-acetamidophenyl)carbamoyl]propylsulfanyl]phenyl]-3-methyl-benzamide CAS Name: N-[3-[[1-(4-acetamidoanilino)-1-oxobutan-2-yl]thio]phenyl]-3-methylbenzamide IUPAC Name: N-[3-[1-(4-acetamidoanilino)-1-oxobutan-2-yl]sulfanylphenyl]-3-methylbenzamide Traditional Name: N-[3-[1-[(4-acetamidophenyl)carbamoyl]propylthio]phenyl]-3-methyl-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C26H27N3O3S/c1-4-24(26(32)28-21-13-11-20(12-14-21)27-18(3)30)33-23-10-6-9-22(16-23)29-25(31)19-8-5-7-17(2)15-19/h5-16,24H,4H2,1-3H3,(H,27,30)(H,28,32)(H,29,31)