N-[4-[(3-bromophenyl)amino]-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazolin-6-yl]prop-2-enamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazolin-6-yl]prop-2-enamide Openeye Name: N-[4-(3-bromoanilino)-7-[3-(1-methyl-4-piperidyl)propoxy]quinazolin-6-yl]prop-2-enamide CAS Name: N-[4-(3-bromoanilino)-7-[3-(1-methyl-4-piperidinyl)propoxy]-6-quinazolinyl]-2-propenamide IUPAC Name: N-[4-(3-bromoanilino)-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazolin-6-yl]prop-2-enamide Traditional Name: N-[4-(3-bromoanilino)-7-[3-(1-methyl-4-piperidyl)propoxy]quinazolin-6-yl]acrylamide Formula: C26H30BrN5O2 MolecularWeight: 524.4527

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)NC(=O)C=C

Isomeric SMILES

CN1CCC(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)NC(=O)C=C

InChI

InChI=1S/C26H30BrN5O2/c1-3-25(33)31-23-15-21-22(28-17-29-26(21)30-20-8-4-7-19(27)14-20)16-24(23)34-13-5-6-18-9-11-32(2)12-10-18/h3-4,7-8,14-18H,1,5-6,9-13H2,2H3,(H,31,33)(H,28,29,30)