1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]ethanone

Systemtic Name: 1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]ethanone Openeye Name: 1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone CAS Name: 1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]ethanone IUPAC Name: 1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-5-yl]ethanone Traditional Name: 1-[4-(4-chlorophenyl)-6-(4-methoxyphenyl)-3-phenyl-2-thioxo-1,6-dihydropyrimidin-5-yl]ethanone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O2S/c1-16(29)22-23(17-10-14-21(30-2)15-11-17)27-25(31)28(20-6-4-3-5-7-20)24(22)18-8-12-19(26)13-9-18/h3-15,23H,1-2H3,(H,27,31)