(4S)-N-(3-chloranyl-2-methyl-phenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-N-(3-chloranyl-2-methyl-phenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-N-(3-chloro-2-methyl-phenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-N-(3-chloro-2-methylphenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-N-(3-chloro-2-methylphenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-N-(3-chloro-2-methyl-phenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(NC(=S)NC2C3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(NC(=S)N[C@H]2C3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H22ClN3O3S/c1-11-15(22)6-5-7-16(11)24-20(26)18-12(2)23-21(29)25-19(18)14-10-13(27-3)8-9-17(14)28-4/h5-10,19H,1-4H3,(H,24,26)(H2,23,25,29)/t19-/m0/s1