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

Systemtic Name: 4-(4-bromanyl-3-nitro-phenyl)-N-(2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(4-bromo-3-nitro-phenyl)-N-(2-ethoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(4-bromo-3-nitrophenyl)-N-(2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(4-bromo-3-nitrophenyl)-N-(2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(4-bromo-3-nitro-phenyl)-6-methyl-N-o-phenetyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C20H19BrN4O4S MolecularWeight: 491.35826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=C(NC(=S)NC2C3=CC(=C(C=C3)Br)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(NC(=S)NC2C3=CC(=C(C=C3)Br)[N+](=O)[O-])C

InChI

InChI=1S/C20H19BrN4O4S/c1-3-29-16-7-5-4-6-14(16)23-19(26)17-11(2)22-20(30)24-18(17)12-8-9-13(21)15(10-12)25(27)28/h4-10,18H,3H2,1-2H3,(H,23,26)(H2,22,24,30)