N-[4-[(2S)-2-methylpiperidin-1-yl]carbonylphenyl]-2-(phenylmethylsulfanyl)benzamide

Systemtic Name: N-[4-[(2S)-2-methylpiperidin-1-yl]carbonylphenyl]-2-(phenylmethylsulfanyl)benzamide Openeye Name: 2-benzylsulfanyl-N-[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]benzamide CAS Name: N-[4-[[(2S)-2-methyl-1-piperidinyl]-oxomethyl]phenyl]-2-(phenylmethylthio)benzamide IUPAC Name: 2-benzylsulfanyl-N-[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]benzamide Traditional Name: 2-(benzylthio)-N-[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]benzamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2S/c1-20-9-7-8-18-29(20)27(31)22-14-16-23(17-15-22)28-26(30)24-12-5-6-13-25(24)32-19-21-10-3-2-4-11-21/h2-6,10-17,20H,7-9,18-19H2,1H3,(H,28,30)/t20-/m0/s1