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

Systemtic Name: 4-tert-butyl-N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 4-tert-butyl-N-[(2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C26H34ClN3O2S MolecularWeight: 488.08506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N[C@@H](CCSC)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C26H34ClN3O2S/c1-26(2,3)20-10-8-19(9-11-20)24(31)28-23(12-17-33-4)25(32)30-15-13-29(14-16-30)22-7-5-6-21(27)18-22/h5-11,18,23H,12-17H2,1-4H3,(H,28,31)/t23-/m0/s1