6-(4-methoxyphenyl)-N,3,4-triphenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 6-(4-methoxyphenyl)-N,3,4-triphenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 6-(4-methoxyphenyl)-N,3,4-triphenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 6-(4-methoxyphenyl)-N,3,4-triphenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 6-(4-methoxyphenyl)-N,3,4-triphenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 6-(4-methoxyphenyl)-N,3,4-triphenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C30H25N3O2S MolecularWeight: 491.6034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(N(C(=S)N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=C(N(C(=S)N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C30H25N3O2S/c1-35-25-19-17-21(18-20-25)27-26(29(34)31-23-13-7-3-8-14-23)28(22-11-5-2-6-12-22)33(30(36)32-27)24-15-9-4-10-16-24/h2-20,27H,1H3,(H,31,34)(H,32,36)