2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C20H20ClN5O4 MolecularWeight: 429.8569

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(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/C20H20ClN5O4/c1-3-25(10-18-22-16-9-13(21)7-8-14(16)20(28)24-18)11-19(27)23-15-5-4-6-17(12(15)2)26(29)30/h4-9H,3,10-11H2,1-2H3,(H,23,27)(H,22,24,28)