N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: N-cyclopropyl-3-ethyl-4-methyl-6-(3-nitrophenyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3CC3)C

Isomeric SMILES

CCN1C(=C(C(NC1=S)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3CC3)C

InChI

InChI=1S/C17H20N4O3S/c1-3-20-10(2)14(16(22)18-12-7-8-12)15(19-17(20)25)11-5-4-6-13(9-11)21(23)24/h4-6,9,12,15H,3,7-8H2,1-2H3,(H,18,22)(H,19,25)