2-ethylsulfanyl-N-[(3S)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-ethylsulfanyl-N-[(3S)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide Openeye Name: 2-ethylsulfanyl-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide CAS Name: 2-(ethylthio)-N-[(3S)-2-oxo-3-azepanyl]-3-pyridinecarboxamide IUPAC Name: 2-ethylsulfanyl-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide Traditional Name: 2-(ethylthio)-N-[(3S)-2-ketoazepan-3-yl]nicotinamide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)NC2CCCCNC2=O

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)N[C@H]2CCCCNC2=O

InChI

InChI=1S/C14H19N3O2S/c1-2-20-14-10(6-5-9-16-14)12(18)17-11-7-3-4-8-15-13(11)19/h5-6,9,11H,2-4,7-8H2,1H3,(H,15,19)(H,17,18)/t11-/m0/s1