3-[(2,4-dimethylquinazolin-7-yl)amino]-5-ethoxy-2,4-benzodiazepin-1-one

Systemtic Name: 3-[(2,4-dimethylquinazolin-7-yl)amino]-5-ethoxy-2,4-benzodiazepin-1-one Openeye Name: 3-[(2,4-dimethylquinazolin-7-yl)amino]-5-ethoxy-2,4-benzodiazepin-1-one CAS Name: 3-[(2,4-dimethyl-7-quinazolinyl)amino]-5-ethoxy-2,4-benzodiazepin-1-one IUPAC Name: 3-[(2,4-dimethylquinazolin-7-yl)amino]-5-ethoxy-2,4-benzodiazepin-1-one Traditional Name: 3-[(2,4-dimethylquinazolin-7-yl)amino]-5-ethoxy-2,4-benzodiazepin-1-one Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=O)C2=CC=CC=C21)NC3=CC4=C(C=C3)C(=NC(=N4)C)C

Isomeric SMILES

CCOC1=NC(=NC(=O)C2=CC=CC=C21)NC3=CC4=C(C=C3)C(=NC(=N4)C)C

InChI

InChI=1S/C21H19N5O2/c1-4-28-20-17-8-6-5-7-16(17)19(27)25-21(26-20)24-14-9-10-15-12(2)22-13(3)23-18(15)11-14/h5-11H,4H2,1-3H3,(H,24,25,27)