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

Systemtic Name: 3-(3-bromophenyl)-6-(3-ethoxy-4-oxidanyl-phenyl)-N,N,4-trimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 3-(3-bromophenyl)-6-(3-ethoxy-4-hydroxy-phenyl)-N,N,4-trimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 3-(3-bromophenyl)-6-(3-ethoxy-4-hydroxyphenyl)-N,N,4-trimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-6-(3-ethoxy-4-hydroxyphenyl)-N,N,4-trimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 3-(3-bromophenyl)-6-(3-ethoxy-4-hydroxy-phenyl)-N,N,4-trimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrN3O3S/c1-5-29-18-11-14(9-10-17(18)27)20-19(21(28)25(3)4)13(2)26(22(30)24-20)16-8-6-7-15(23)12-16/h6-12,20,27H,5H2,1-4H3,(H,24,30)