methyl (4R)-4-[3-[(2-chlorophenyl)carbonylamino]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-4-[3-[(2-chlorophenyl)carbonylamino]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-4-[3-[(2-chlorobenzoyl)amino]phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-[3-[[(2-chlorophenyl)-oxomethyl]amino]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-[3-[(2-chlorobenzoyl)amino]phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-[3-[(2-chlorobenzoyl)amino]phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C20H18ClN3O3S/c1-11-16(19(26)27-2)17(24-20(28)22-11)12-6-5-7-13(10-12)23-18(25)14-8-3-4-9-15(14)21/h3-10,17H,1-2H3,(H,23,25)(H2,22,24,28)/t17-/m1/s1