N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[4-[(4-chlorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[4-(4-chlorobenzyl)piperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C24H30ClN3O2 MolecularWeight: 427.9669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H30ClN3O2/c1-17(2)22(26-23(29)21-7-5-4-6-18(21)3)24(30)28-14-12-27(13-15-28)16-19-8-10-20(25)11-9-19/h4-11,17,22H,12-16H2,1-3H3,(H,26,29)/t22-/m0/s1