N-[4-[[3-(phenylmethyl)imidazol-4-yl]amino]quinazolin-6-yl]-3-(prop-2-enoylamino)propanamide

Systemtic Name: N-[4-[[3-(phenylmethyl)imidazol-4-yl]amino]quinazolin-6-yl]-3-(prop-2-enoylamino)propanamide Openeye Name: N-[4-[(3-benzylimidazol-4-yl)amino]quinazolin-6-yl]-3-(prop-2-enoylamino)propanamide CAS Name: 3-(1-oxoprop-2-enylamino)-N-[4-[[3-(phenylmethyl)-4-imidazolyl]amino]-6-quinazolinyl]propanamide IUPAC Name: N-[4-[(3-benzylimidazol-4-yl)amino]quinazolin-6-yl]-3-(prop-2-enoylamino)propanamide Traditional Name: 3-acrylamido-N-[4-[(3-benzylimidazol-4-yl)amino]quinazolin-6-yl]propionamide Formula: C24H23N7O2 MolecularWeight: 441.48512

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CN=CN3CC4=CC=CC=C4

Isomeric SMILES

C=CC(=O)NCCC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CN=CN3CC4=CC=CC=C4

InChI

InChI=1S/C24H23N7O2/c1-2-22(32)26-11-10-23(33)29-18-8-9-20-19(12-18)24(28-15-27-20)30-21-13-25-16-31(21)14-17-6-4-3-5-7-17/h2-9,12-13,15-16H,1,10-11,14H2,(H,26,32)(H,29,33)(H,27,28,30)