N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[2-(4-chlorophenyl)ethylcarbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[2-(4-chlorophenyl)ethylcarbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-27-19-6-4-3-5-17(19)20(25)24-18(12-14-28-2)21(26)23-13-11-15-7-9-16(22)10-8-15/h3-10,18H,11-14H2,1-2H3,(H,23,26)(H,24,25)