(3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperidine-3-carboxamide CAS Name: (3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)-1-oxoprop-2-enyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[(E)-3-(1,3-benzothiazol-2-yl)acryloyl]nipecotamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=NC3=CC=CC=C3S2)C(=O)N

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)/C=C/C2=NC3=CC=CC=C3S2)C(=O)N

InChI

InChI=1S/C16H17N3O2S/c17-16(21)11-4-3-9-19(10-11)15(20)8-7-14-18-12-5-1-2-6-13(12)22-14/h1-2,5-8,11H,3-4,9-10H2,(H2,17,21)/b8-7+/t11-/m1/s1