1-cyclohexyl-5-methyl-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 1-cyclohexyl-5-methyl-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 1-cyclohexyl-5-methyl-3-phenyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 1-cyclohexyl-5-methyl-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 1-cyclohexyl-5-methyl-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 1-cyclohexyl-5-methyl-3-phenyl-2-thioxo-hexahydropyrimidin-4-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(=S)N(C1=O)C2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

CC1CN(C(=S)N(C1=O)C2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C17H22N2OS/c1-13-12-18(14-8-4-2-5-9-14)17(21)19(16(13)20)15-10-6-3-7-11-15/h3,6-7,10-11,13-14H,2,4-5,8-9,12H2,1H3