6-(3-ethoxy-4-oxidanyl-phenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 6-(3-ethoxy-4-oxidanyl-phenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 6-(3-ethoxy-4-hydroxy-phenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 6-(3-ethoxy-4-hydroxyphenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 6-(3-ethoxy-4-hydroxyphenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 6-(3-ethoxy-4-hydroxy-phenyl)-N-(3-methoxyphenyl)-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C)C)C(=O)NC3=CC(=CC=C3)OC)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C)C)C(=O)NC3=CC(=CC=C3)OC)O

InChI

InChI=1S/C22H25N3O4S/c1-5-29-18-11-14(9-10-17(18)26)20-19(13(2)25(3)22(30)24-20)21(27)23-15-7-6-8-16(12-15)28-4/h6-12,20,26H,5H2,1-4H3,(H,23,27)(H,24,30)