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

Systemtic Name: 7-azanyl-4-(2-methyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)carbonyl-1,2,5-dithiazocan-6-one Openeye Name: 7-amino-4-[2-methyl-4-(naphthalene-1-carbonyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one CAS Name: 7-amino-4-[[2-methyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1,2,5-dithiazocan-6-one IUPAC Name: 7-amino-4-[2-methyl-4-(naphthalene-1-carbonyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one Traditional Name: 7-amino-4-[2-methyl-4-(1-naphthoyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2CSSCC(C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1CN(CCN1C(=O)C2CSSCC(C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O3S2/c1-14-11-25(21(28)17-8-4-6-15-5-2-3-7-16(15)17)9-10-26(14)22(29)19-13-31-30-12-18(23)20(27)24-19/h2-8,14,18-19H,9-13,23H2,1H3,(H,24,27)