N-[(E)-pyridin-3-ylmethylideneamino]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(E)-pyridin-3-ylmethylideneamino]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(E)-3-pyridylmethyleneamino]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(E)-3-pyridinylmethylideneamino]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(E)-pyridin-3-ylmethylideneamino]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(E)-3-pyridylmethyleneamino]-1-(2-thienylsulfonyl)isonipecotamide Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NN=CC2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)N/N=C/C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H18N4O3S2/c21-16(19-18-12-13-3-1-7-17-11-13)14-5-8-20(9-6-14)25(22,23)15-4-2-10-24-15/h1-4,7,10-12,14H,5-6,8-9H2,(H,19,21)/b18-12+