N-(4-bromanyl-2-methyl-phenyl)-4-[(4-tert-butylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-4-[(4-tert-butylphenyl)methyl]piperazine-1-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-4-[(4-tert-butylphenyl)methyl]piperazine-1-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-4-[(4-tert-butylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-4-[(4-tert-butylphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-(4-tert-butylbenzyl)piperazine-1-carboxamide Formula: C23H30BrN3O MolecularWeight: 444.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H30BrN3O/c1-17-15-20(24)9-10-21(17)25-22(28)27-13-11-26(12-14-27)16-18-5-7-19(8-6-18)23(2,3)4/h5-10,15H,11-14,16H2,1-4H3,(H,25,28)