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

Systemtic Name: N-[1-(azepan-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[1-(azepane-1-carbonyl)-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[1-(1-azepanyl)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[1-(azepan-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[1-(azepane-1-carbonyl)-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)N2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)N2CCCCCC2

InChI

InChI=1S/C19H28N2O3S/c1-24-16-9-7-15(8-10-16)18(22)20-17(11-14-25-2)19(23)21-12-5-3-4-6-13-21/h7-10,17H,3-6,11-14H2,1-2H3,(H,20,22)