1-(azepan-1-yl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)propan-1-one CAS Name: 1-(1-azepanyl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)propan-1-one Formula: C16H29N3OS MolecularWeight: 311.48596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(=S)N1CCC(=O)N2CCCCCC2)(C)C

Isomeric SMILES

CC1CC(NC(=S)N1CCC(=O)N2CCCCCC2)(C)C

InChI

InChI=1S/C16H29N3OS/c1-13-12-16(2,3)17-15(21)19(13)11-8-14(20)18-9-6-4-5-7-10-18/h13H,4-12H2,1-3H3,(H,17,21)