(4R)-4-(3-chloranyl-4-methoxy-phenyl)-N-(4-ethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4R)-4-(3-chloranyl-4-methoxy-phenyl)-N-(4-ethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4R)-4-(3-chloro-4-methoxy-phenyl)-N-(4-ethylphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4R)-4-(3-chloro-4-methoxyphenyl)-N-(4-ethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4R)-4-(3-chloro-4-methoxyphenyl)-N-(4-ethylphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4R)-4-(3-chloro-4-methoxy-phenyl)-N-(4-ethylphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(NC(=S)NC2C3=CC(=C(C=C3)OC)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(NC(=S)N[C@@H]2C3=CC(=C(C=C3)OC)Cl)C

InChI

InChI=1S/C21H22ClN3O2S/c1-4-13-5-8-15(9-6-13)24-20(26)18-12(2)23-21(28)25-19(18)14-7-10-17(27-3)16(22)11-14/h5-11,19H,4H2,1-3H3,(H,24,26)(H2,23,25,28)/t19-/m1/s1