3-(3-chlorophenyl)-5-ethyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 3-(3-chlorophenyl)-5-ethyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 3-(3-chlorophenyl)-5-ethyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 3-(3-chlorophenyl)-5-ethyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 3-(3-chlorophenyl)-5-ethyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 3-(3-chlorophenyl)-5-ethyl-2-thioxo-hexahydropyrimidin-4-one Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CNC(=S)N(C1=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCC1CNC(=S)N(C1=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H13ClN2OS/c1-2-8-7-14-12(17)15(11(8)16)10-5-3-4-9(13)6-10/h3-6,8H,2,7H2,1H3,(H,14,17)