4-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: 4-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(thiophen-2-ylmethyl)benzamide Openeye Name: 4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(2-thienylmethyl)benzamide CAS Name: 4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: 4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(thiophen-2-ylmethyl)benzamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-4-nitro-N-(2-thenyl)benzamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CN(CC3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CN(CC3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4S/c26-20-17-5-1-2-6-18(17)22-19(23-20)13-24(12-16-4-3-11-30-16)21(27)14-7-9-15(10-8-14)25(28)29/h1-11H,12-13H2,(H,22,23,26)