1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]urea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]urea Openeye Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]urea CAS Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]urea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]urea Traditional Name: 1-(2,6-dimethylphenyl)-3-[6-methoxy-7-[3-(4-methylpiperazino)propoxy]quinazolin-4-yl]urea Formula: C26H34N6O3 MolecularWeight: 478.58656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N6O3/c1-18-7-5-8-19(2)24(18)29-26(33)30-25-20-15-22(34-4)23(16-21(20)27-17-28-25)35-14-6-9-32-12-10-31(3)11-13-32/h5,7-8,15-17H,6,9-14H2,1-4H3,(H2,27,28,29,30,33)