7-azanyl-4-[(2-methyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)methyl]-1,2,5-dithiazocan-6-one

Systemtic Name: 7-azanyl-4-[(2-methyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)methyl]-1,2,5-dithiazocan-6-one Openeye Name: 7-amino-4-[[2-methyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]methyl]-1,2,5-dithiazocan-6-one CAS Name: 7-amino-4-[[2-methyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]methyl]-1,2,5-dithiazocan-6-one IUPAC Name: 7-amino-4-[[2-methyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]methyl]-1,2,5-dithiazocan-6-one Traditional Name: 7-amino-4-[[2-methyl-4-(1-naphthoyl)piperazino]methyl]-1,2,5-dithiazocan-6-one Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2CSSCC(C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1CN(CCN1CC2CSSCC(C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H28N4O2S2/c1-15-11-26(22(28)19-8-4-6-16-5-2-3-7-18(16)19)10-9-25(15)12-17-13-29-30-14-20(23)21(27)24-17/h2-8,15,17,20H,9-14,23H2,1H3,(H,24,27)