(3S)-N3-[2-(1,3-benzothiazol-2-yl)ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-[2-(1,3-benzothiazol-2-yl)ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-[2-(1,3-benzothiazol-2-yl)ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-[2-(1,3-benzothiazol-2-yl)ethyl]-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-[2-(1,3-benzothiazol-2-yl)ethyl]-N-phenyl-piperidine-1,3-dicarboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N4O2S/c27-21(23-13-12-20-25-18-10-4-5-11-19(18)29-20)16-7-6-14-26(15-16)22(28)24-17-8-2-1-3-9-17/h1-5,8-11,16H,6-7,12-15H2,(H,23,27)(H,24,28)/t16-/m0/s1