2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[6-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C19H17ClN2O3S/c1-25-14-8-4-12(5-9-14)18-15(10-16(23)24)17(21-19(26)22-18)11-2-6-13(20)7-3-11/h2-9,18H,10H2,1H3,(H,23,24)(H2,21,22,26)