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

Systemtic Name: N-[1-[2-(cyclohexen-1-yl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[2-(cyclohexen-1-yl)ethylcarbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[2-(1-cyclohexenyl)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[2-(cyclohexen-1-yl)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[2-(cyclohexen-1-yl)ethylcarbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=CCCCC2

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=CCCCC2

InChI

InChI=1S/C21H30N2O3S/c1-26-19-11-7-6-10-17(19)20(24)23-18(13-15-27-2)21(25)22-14-12-16-8-4-3-5-9-16/h6-8,10-11,18H,3-5,9,12-15H2,1-2H3,(H,22,25)(H,23,24)