ethyl 2-imidazol-1-yl-4-[(phenylmethyl)amino]quinazoline-6-carboxylate

Systemtic Name: ethyl 2-imidazol-1-yl-4-[(phenylmethyl)amino]quinazoline-6-carboxylate Openeye Name: ethyl 4-(benzylamino)-2-imidazol-1-yl-quinazoline-6-carboxylate CAS Name: 2-(1-imidazolyl)-4-[(phenylmethyl)amino]-6-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-2-imidazol-1-ylquinazoline-6-carboxylate Traditional Name: 4-(benzylamino)-2-imidazol-1-yl-quinazoline-6-carboxylic acid ethyl ester Formula: C21H19N5O2 MolecularWeight: 373.40786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)N4C=CN=C4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)N4C=CN=C4

InChI

InChI=1S/C21H19N5O2/c1-2-28-20(27)16-8-9-18-17(12-16)19(23-13-15-6-4-3-5-7-15)25-21(24-18)26-11-10-22-14-26/h3-12,14H,2,13H2,1H3,(H,23,24,25)