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

Systemtic Name: 4-(5-bromanyl-2-ethoxy-phenyl)-6-methyl-N-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide; propane Openeye Name: 4-(5-bromo-2-ethoxy-phenyl)-6-methyl-N-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide; propane CAS Name: 4-(5-bromo-2-ethoxyphenyl)-6-methyl-N-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide; propane IUPAC Name: 4-(5-bromo-2-ethoxyphenyl)-6-methyl-N-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide; propane Traditional Name: 4-(5-bromo-2-ethoxy-phenyl)-6-methyl-N-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide; n-propane Formula: C24H30BrN3O2S MolecularWeight: 504.4829

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC.CCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H22BrN3O2S.C3H8/c1-4-27-17-10-7-14(22)11-16(17)19-18(13(3)23-21(28)25-19)20(26)24-15-8-5-12(2)6-9-15;1-3-2/h5-11,19H,4H2,1-3H3,(H,24,26)(H2,23,25,28);3H2,1-2H3