4-(4-chlorophenyl)-6-methyl-N-pyrimidin-2-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(4-chlorophenyl)-6-methyl-N-pyrimidin-2-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(4-chlorophenyl)-6-methyl-N-pyrimidin-2-yl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(4-chlorophenyl)-6-methyl-N-(2-pyrimidinyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(4-chlorophenyl)-6-methyl-N-pyrimidin-2-yl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(4-chlorophenyl)-6-methyl-N-(2-pyrimidyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C16H14ClN5OS MolecularWeight: 359.83326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)Cl)C(=O)NC3=NC=CC=N3

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)Cl)C(=O)NC3=NC=CC=N3

InChI

InChI=1S/C16H14ClN5OS/c1-9-12(14(23)22-15-18-7-2-8-19-15)13(21-16(24)20-9)10-3-5-11(17)6-4-10/h2-8,13H,1H3,(H2,20,21,24)(H,18,19,22,23)