N-(3-methylphenyl)-2-[(2S)-3-oxidanylidene-1,4-bis(phenylmethyl)piperazin-2-yl]ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[(2S)-3-oxidanylidene-1,4-bis(phenylmethyl)piperazin-2-yl]ethanamide Openeye Name: 2-[(2S)-1,4-dibenzyl-3-oxo-piperazin-2-yl]-N-(m-tolyl)acetamide CAS Name: N-(3-methylphenyl)-2-[(2S)-3-oxo-1,4-bis(phenylmethyl)-2-piperazinyl]acetamide IUPAC Name: 2-[(2S)-1,4-dibenzyl-3-oxopiperazin-2-yl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[(2S)-1,4-dibenzyl-3-keto-piperazin-2-yl]-N-(m-tolyl)acetamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC2C(=O)N(CCN2CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C[C@H]2C(=O)N(CCN2CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-21-9-8-14-24(17-21)28-26(31)18-25-27(32)30(20-23-12-6-3-7-13-23)16-15-29(25)19-22-10-4-2-5-11-22/h2-14,17,25H,15-16,18-20H2,1H3,(H,28,31)/t25-/m0/s1