2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propyl-amino]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylamino]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylamino]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-propyl-amino]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C21H22ClN5O4 MolecularWeight: 443.88348

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H22ClN5O4/c1-3-8-26(11-19-23-18-9-14(22)5-7-16(18)21(29)25-19)12-20(28)24-17-10-15(27(30)31)6-4-13(17)2/h4-7,9-10H,3,8,11-12H2,1-2H3,(H,24,28)(H,23,25,29)