N-butyl-3-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-butyl-3-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-butyl-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-pyrrolidin-1-yl-benzamide CAS Name: N-butyl-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-butyl-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: N-butyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H27N5O4/c1-2-3-12-28(16-22-25-19-9-5-4-8-18(19)23(30)26-22)24(31)17-10-11-20(21(15-17)29(32)33)27-13-6-7-14-27/h4-5,8-11,15H,2-3,6-7,12-14,16H2,1H3,(H,25,26,30)