3-[3-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 3-[3-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: 3-[3-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 3-[3-[[[4-(methylthio)phenyl]methylamino]-oxomethyl]phenyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 3-[3-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-N-phenylpiperidine-1-carboxamide Traditional Name: 3-[3-[[4-(methylthio)benzyl]carbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)C3CCCN(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)C3CCCN(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-33-25-14-12-20(13-15-25)18-28-26(31)22-8-5-7-21(17-22)23-9-6-16-30(19-23)27(32)29-24-10-3-2-4-11-24/h2-5,7-8,10-15,17,23H,6,9,16,18-19H2,1H3,(H,28,31)(H,29,32)