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

Systemtic Name: 4-(4-bromanyl-3-nitro-phenyl)-N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(4-bromo-3-nitro-phenyl)-N-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(4-bromo-3-nitrophenyl)-N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(4-bromo-3-nitrophenyl)-N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(4-bromo-3-nitro-phenyl)-N-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C20H19BrN4O5S MolecularWeight: 507.35766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C20H19BrN4O5S/c1-10-17(19(26)23-14-9-12(29-2)5-7-16(14)30-3)18(24-20(31)22-10)11-4-6-13(21)15(8-11)25(27)28/h4-9,18H,1-3H3,(H,23,26)(H2,22,24,31)