N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide

Systemtic Name: N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide Openeye Name: N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)butanamide CAS Name: N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide IUPAC Name: N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-sulfanylidene-1,3-diazinan-1-yl)butanamide Traditional Name: N-(4-bromophenyl)-4-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)butyramide Formula: C17H24BrN3OS MolecularWeight: 398.36096

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(=S)N1CCCC(=O)NC2=CC=C(C=C2)Br)(C)C

Isomeric SMILES

CC1CC(NC(=S)N1CCCC(=O)NC2=CC=C(C=C2)Br)(C)C

InChI

InChI=1S/C17H24BrN3OS/c1-12-11-17(2,3)20-16(23)21(12)10-4-5-15(22)19-14-8-6-13(18)7-9-14/h6-9,12H,4-5,10-11H2,1-3H3,(H,19,22)(H,20,23)