1-(azepan-1-yl)-2-(1-methylindol-3-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(1-methylindol-3-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(1-methylindol-3-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(1-methyl-3-indolyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(1-methylindol-3-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(1-methylindol-3-yl)thio]ethanone Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)SCC(=O)N3CCCCCC3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)SCC(=O)N3CCCCCC3

InChI

InChI=1S/C17H22N2OS/c1-18-12-16(14-8-4-5-9-15(14)18)21-13-17(20)19-10-6-2-3-7-11-19/h4-5,8-9,12H,2-3,6-7,10-11,13H2,1H3