4-tert-butyl-N-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-benzamide

Systemtic Name: 4-tert-butyl-N-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-benzamide Openeye Name: N-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-4-tert-butyl-N-phenethyl-benzamide CAS Name: 4-tert-butyl-N-[3-[4-(diphenylmethyl)-1-piperazinyl]-3-oxopropyl]-N-phenethylbenzamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-1-yl)-3-oxopropyl]-4-tert-butyl-N-phenethylbenzamide Traditional Name: N-[3-(4-benzhydrylpiperazino)-3-keto-propyl]-4-tert-butyl-N-phenethyl-benzamide Formula: C39H45N3O2 MolecularWeight: 587.7935

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C39H45N3O2/c1-39(2,3)35-21-19-34(20-22-35)38(44)42(25-23-31-13-7-4-8-14-31)26-24-36(43)40-27-29-41(30-28-40)37(32-15-9-5-10-16-32)33-17-11-6-12-18-33/h4-22,37H,23-30H2,1-3H3