4-chloranyl-N-[(2S)-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-3-methylsulfanyl-1-[4-(o-tolylmethyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 4-chloro-N-[(2S)-1-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-1-[4-(2-methylbenzyl)piperazine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C24H30ClN3O2S MolecularWeight: 460.0319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C(CCSC)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)[C@H](CCSC)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H30ClN3O2S/c1-18-5-3-4-6-20(18)17-27-12-14-28(15-13-27)24(30)22(11-16-31-2)26-23(29)19-7-9-21(25)10-8-19/h3-10,22H,11-17H2,1-2H3,(H,26,29)/t22-/m0/s1