1-tert-butyl-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-piperidin-1-ylcarbonyl-phenyl]urea

Systemtic Name: 1-tert-butyl-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-piperidin-1-ylcarbonyl-phenyl]urea Openeye Name: 1-tert-butyl-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(piperidine-1-carbonyl)phenyl]urea CAS Name: 1-tert-butyl-3-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-[oxo(1-piperidinyl)methyl]phenyl]urea IUPAC Name: 1-tert-butyl-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(piperidine-1-carbonyl)phenyl]urea Traditional Name: 1-tert-butyl-3-[4-[4-(2-methoxyphenyl)piperazino]-3-(piperidine-1-carbonyl)phenyl]urea Formula: C28H39N5O3 MolecularWeight: 493.64096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)N4CCCCC4

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)N4CCCCC4

InChI

InChI=1S/C28H39N5O3/c1-28(2,3)30-27(35)29-21-12-13-23(22(20-21)26(34)33-14-8-5-9-15-33)31-16-18-32(19-17-31)24-10-6-7-11-25(24)36-4/h6-7,10-13,20H,5,8-9,14-19H2,1-4H3,(H2,29,30,35)