N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[4-[ethyl(isopropyl)amino]phenyl]-2-(7-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(7-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-[ethyl(isopropyl)amino]phenyl]-2-(4-keto-7-nitro-quinazolin-3-yl)acetamide Formula: C21H23N5O4 MolecularWeight: 409.43842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C21H23N5O4/c1-4-25(14(2)3)16-7-5-15(6-8-16)23-20(27)12-24-13-22-19-11-17(26(29)30)9-10-18(19)21(24)28/h5-11,13-14H,4,12H2,1-3H3,(H,23,27)