1-(4-tert-butylphenyl)-3-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylindolin-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methyl-1-piperazinyl)ethyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[2-(1-methylindolin-5-yl)-2-(4-methylpiperazino)ethyl]urea Formula: C27H39N5O MolecularWeight: 449.63146

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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(CC3)C)N4CCN(CC4)C

Isomeric SMILES

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

InChI

InChI=1S/C27H39N5O/c1-27(2,3)22-7-9-23(10-8-22)29-26(33)28-19-25(32-16-14-30(4)15-17-32)20-6-11-24-21(18-20)12-13-31(24)5/h6-11,18,25H,12-17,19H2,1-5H3,(H2,28,29,33)