1-(azepan-1-yl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(1-benzylindol-3-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[[1-(phenylmethyl)-3-indolyl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(1-benzylindol-3-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(1-benzylindol-3-yl)thio]ethanone Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2OS/c26-23(24-14-8-1-2-9-15-24)18-27-22-17-25(16-19-10-4-3-5-11-19)21-13-7-6-12-20(21)22/h3-7,10-13,17H,1-2,8-9,14-16,18H2