[4-(1,2,5-dithiazepan-4-ylmethyl)-3-methyl-piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-(1,2,5-dithiazepan-4-ylmethyl)-3-methyl-piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-(1,2,5-dithiazepan-4-ylmethyl)-3-methyl-piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [4-(1,2,5-dithiazepan-4-ylmethyl)-3-methyl-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [4-(1,2,5-dithiazepan-4-ylmethyl)-3-methylpiperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-(1,2,5-dithiazepan-4-ylmethyl)-3-methyl-piperazino]-(1-naphthyl)methanone Formula: C21H27N3OS2 MolecularWeight: 401.58858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2CSSCCN2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1CN(CCN1CC2CSSCCN2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H27N3OS2/c1-16-13-24(11-10-23(16)14-18-15-27-26-12-9-22-18)21(25)20-8-4-6-17-5-2-3-7-19(17)20/h2-8,16,18,22H,9-15H2,1H3