N-[3-[1-[(3,4-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[3-[1-[(3,4-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[3-[1-[(3,4-dimethylphenyl)carbamoyl]propylsulfanyl]phenyl]-2,6-dimethoxy-benzamide CAS Name: N-[3-[[1-(3,4-dimethylanilino)-1-oxobutan-2-yl]thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[3-[1-(3,4-dimethylanilino)-1-oxobutan-2-yl]sulfanylphenyl]-2,6-dimethoxybenzamide Traditional Name: N-[3-[1-[(3,4-dimethylphenyl)carbamoyl]propylthio]phenyl]-2,6-dimethoxy-benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C27H30N2O4S/c1-6-24(26(30)28-20-14-13-17(2)18(3)15-20)34-21-10-7-9-19(16-21)29-27(31)25-22(32-4)11-8-12-23(25)33-5/h7-16,24H,6H2,1-5H3,(H,28,30)(H,29,31)