1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methyl-1-piperazinyl)ethyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(4-methylpiperazino)ethyl]urea Formula: C28H41N5O MolecularWeight: 463.65804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)NCC(C2=CC3=C(C=C2)N(CCC3)C)N4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NCC(C2=CC3=C(C=C2)N(CCC3)C)N4CCN(CC4)C

InChI

InChI=1S/C28H41N5O/c1-28(2,3)23-9-11-24(12-10-23)30-27(34)29-20-26(33-17-15-31(4)16-18-33)22-8-13-25-21(19-22)7-6-14-32(25)5/h8-13,19,26H,6-7,14-18,20H2,1-5H3,(H2,29,30,34)