4-(5-bromanyl-2,3-dimethoxy-phenyl)-6-methyl-N-(2-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(5-bromanyl-2,3-dimethoxy-phenyl)-6-methyl-N-(2-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(5-bromo-2,3-dimethoxy-phenyl)-6-methyl-N-(o-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(5-bromo-2,3-dimethoxyphenyl)-6-methyl-N-(2-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(5-bromo-2,3-dimethoxyphenyl)-6-methyl-N-(2-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(5-bromo-2,3-dimethoxy-phenyl)-6-methyl-N-(o-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22BrN3O3S MolecularWeight: 476.38668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(NC(=S)NC2C3=CC(=CC(=C3OC)OC)Br)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(NC(=S)NC2C3=CC(=CC(=C3OC)OC)Br)C

InChI

InChI=1S/C21H22BrN3O3S/c1-11-7-5-6-8-15(11)24-20(26)17-12(2)23-21(29)25-18(17)14-9-13(22)10-16(27-3)19(14)28-4/h5-10,18H,1-4H3,(H,24,26)(H2,23,25,29)