3-ethyl-N-methyl-N-[(2-nitrophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-N-methyl-N-[(2-nitrophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-N-methyl-N-[(2-nitrophenyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-methyl-N-[(2-nitrophenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-N-methyl-N-[(2-nitrophenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-N-methyl-N-(2-nitrobenzyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=CC=C3[N+](=O)[O-])NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=CC=C3[N+](=O)[O-])NC1=S

InChI

InChI=1S/C19H18N4O4S/c1-3-22-18(25)14-9-8-12(10-15(14)20-19(22)28)17(24)21(2)11-13-6-4-5-7-16(13)23(26)27/h4-10H,3,11H2,1-2H3,(H,20,28)