N-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]quinazolin-7-yl]prop-2-enamide

Systemtic Name: N-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]quinazolin-7-yl]prop-2-enamide Openeye Name: N-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]quinazolin-7-yl]prop-2-enamide CAS Name: N-[4-[[2-(phenylmethyl)-3H-benzimidazol-5-yl]amino]-7-quinazolinyl]-2-propenamide IUPAC Name: N-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]quinazolin-7-yl]prop-2-enamide Traditional Name: N-[4-[(2-benzyl-3H-benzimidazol-5-yl)amino]quinazolin-7-yl]acrylamide Formula: C25H20N6O MolecularWeight: 420.4659

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC1=CC2=C(C=C1)C(=NC=N2)NC3=CC4=C(C=C3)N=C(N4)CC5=CC=CC=C5

Isomeric SMILES

C=CC(=O)NC1=CC2=C(C=C1)C(=NC=N2)NC3=CC4=C(C=C3)N=C(N4)CC5=CC=CC=C5

InChI

InChI=1S/C25H20N6O/c1-2-24(32)28-17-8-10-19-21(13-17)26-15-27-25(19)29-18-9-11-20-22(14-18)31-23(30-20)12-16-6-4-3-5-7-16/h2-11,13-15H,1,12H2,(H,28,32)(H,30,31)(H,26,27,29)