(2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)-[(4R)-1,2,5-dithiazepan-4-yl]methanone

Systemtic Name: (2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)-[(4R)-1,2,5-dithiazepan-4-yl]methanone Openeye Name: [2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-[(4R)-1,2,5-dithiazepan-4-yl]methanone CAS Name: [2-butyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-[(4R)-1,2,5-dithiazepan-4-yl]methanone IUPAC Name: [2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-[(4R)-1,2,5-dithiazepan-4-yl]methanone Traditional Name: [2-butyl-4-(1-naphthoyl)piperazino]-[(4R)-1,2,5-dithiazepan-4-yl]methanone Formula: C24H31N3O2S2 MolecularWeight: 457.65184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=O)C2CSSCCN2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCC1CN(CCN1C(=O)[C@@H]2CSSCCN2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H31N3O2S2/c1-2-3-9-19-16-26(13-14-27(19)24(29)22-17-31-30-15-12-25-22)23(28)21-11-6-8-18-7-4-5-10-20(18)21/h4-8,10-11,19,22,25H,2-3,9,12-17H2,1H3/t19?,22-/m0/s1