1-(2,4-dimethoxyphenyl)-1-[1-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-propan-2-yl-urea

Systemtic Name: 1-(2,4-dimethoxyphenyl)-1-[1-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-propan-2-yl-urea Openeye Name: 1-(2,4-dimethoxyphenyl)-3-isopropyl-1-[1-[3-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-2-yl]ethyl]urea CAS Name: 1-(2,4-dimethoxyphenyl)-1-[1-[3-(4-methyl-1-piperazinyl)-4-oxo-2-quinazolinyl]ethyl]-3-propan-2-ylurea IUPAC Name: 1-(2,4-dimethoxyphenyl)-1-[1-[3-(4-methylpiperazin-1-yl)-4-oxoquinazolin-2-yl]ethyl]-3-propan-2-ylurea Traditional Name: 1-(2,4-dimethoxyphenyl)-3-isopropyl-1-[1-[4-keto-3-(4-methylpiperazino)quinazolin-2-yl]ethyl]urea Formula: C27H36N6O4 MolecularWeight: 508.61254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N(C1=C(C=C(C=C1)OC)OC)C(C)C2=NC3=CC=CC=C3C(=O)N2N4CCN(CC4)C

Isomeric SMILES

CC(C)NC(=O)N(C1=C(C=C(C=C1)OC)OC)C(C)C2=NC3=CC=CC=C3C(=O)N2N4CCN(CC4)C

InChI

InChI=1S/C27H36N6O4/c1-18(2)28-27(35)32(23-12-11-20(36-5)17-24(23)37-6)19(3)25-29-22-10-8-7-9-21(22)26(34)33(25)31-15-13-30(4)14-16-31/h7-12,17-19H,13-16H2,1-6H3,(H,28,35)