S-(3-phenylpropyl) 1-(phenylcarbamoyl)piperidine-2-carbothioate

Systemtic Name: S-(3-phenylpropyl) 1-(phenylcarbamoyl)piperidine-2-carbothioate Openeye Name: S-(3-phenylpropyl) 1-(phenylcarbamoyl)piperidine-2-carbothioate CAS Name: 1-[anilino(oxo)methyl]-2-piperidinecarbothioic acid S-(3-phenylpropyl) ester IUPAC Name: S-(3-phenylpropyl) 1-(phenylcarbamoyl)piperidine-2-carbothioate Traditional Name: 1-(phenylcarbamoyl)piperidine-2-carbothioic acid S-(3-phenylpropyl) ester Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)SCCCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)SCCCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S/c25-21(27-17-9-12-18-10-3-1-4-11-18)20-15-7-8-16-24(20)22(26)23-19-13-5-2-6-14-19/h1-6,10-11,13-14,20H,7-9,12,15-17H2,(H,23,26)