4-tert-butyl-N-[1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[2-[4-(4-ethylbenzoyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]benzamide CAS Name: 4-tert-butyl-N-[1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-1-oxopropan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[1-[4-(4-ethylbenzoyl)piperazin-1-yl]-1-oxopropan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[2-[4-(4-ethylbenzoyl)piperazino]-2-keto-1-methyl-ethyl]benzamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H35N3O3/c1-6-20-7-9-22(10-8-20)26(33)30-17-15-29(16-18-30)25(32)19(2)28-24(31)21-11-13-23(14-12-21)27(3,4)5/h7-14,19H,6,15-18H2,1-5H3,(H,28,31)