N-[1-[(3,4-dimethoxyphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[1-[(3,4-dimethoxyphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-[1-[(3,4-dimethoxyphenyl)carbamoyl]-3-methylsulfanyl-propyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-[1-(3,4-dimethoxyanilino)-4-(methylthio)-1-oxobutan-2-yl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[1-(3,4-dimethoxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[1-[(3,4-dimethoxyphenyl)carbamoyl]-3-(methylthio)propyl]-4-methyl-cyclohexanecarboxamide Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1CCC(CC1)C(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H32N2O4S/c1-14-5-7-15(8-6-14)20(24)23-17(11-12-28-4)21(25)22-16-9-10-18(26-2)19(13-16)27-3/h9-10,13-15,17H,5-8,11-12H2,1-4H3,(H,22,25)(H,23,24)