1-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-3-(3-chloranyl-4-methyl-phenyl)urea

Systemtic Name: 1-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-3-(3-chloranyl-4-methyl-phenyl)urea Openeye Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-3-(3-chloro-4-methyl-phenyl)urea CAS Name: 1-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-(3-chloro-4-methylphenyl)urea IUPAC Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-3-(3-chloro-4-methylphenyl)urea Traditional Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]-3-(3-chloro-4-methyl-phenyl)urea Formula: C29H33ClN4O2 MolecularWeight: 505.05092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C29H33ClN4O2/c1-20-5-10-24(19-26(20)30)32-28(36)31-23-11-13-25(14-12-23)33-15-17-34(18-16-33)27(35)21-6-8-22(9-7-21)29(2,3)4/h5-14,19H,15-18H2,1-4H3,(H2,31,32,36)