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

Systemtic Name: N-[4-[(3-methylphenyl)amino]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-6-yl]prop-2-enamide Openeye Name: N-[4-(3-methylanilino)-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-6-yl]prop-2-enamide CAS Name: N-[4-(3-methylanilino)-7-[3-(4-methyl-1-piperazinyl)propoxy]-6-quinazolinyl]-2-propenamide IUPAC Name: N-[4-(3-methylanilino)-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-6-yl]prop-2-enamide Traditional Name: N-[7-[3-(4-methylpiperazino)propoxy]-4-(m-toluidino)quinazolin-6-yl]acrylamide Formula: C26H32N6O2 MolecularWeight: 460.57128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)NC(=O)C=C)OCCCN4CCN(CC4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)NC(=O)C=C)OCCCN4CCN(CC4)C

InChI

InChI=1S/C26H32N6O2/c1-4-25(33)30-23-16-21-22(27-18-28-26(21)29-20-8-5-7-19(2)15-20)17-24(23)34-14-6-9-32-12-10-31(3)11-13-32/h4-5,7-8,15-18H,1,6,9-14H2,2-3H3,(H,30,33)(H,27,28,29)