6-(2,3-dimethylphenoxy)-N-[(3R)-2-oxidanylidenethiolan-3-yl]pyridine-3-carboxamide

Systemtic Name: 6-(2,3-dimethylphenoxy)-N-[(3R)-2-oxidanylidenethiolan-3-yl]pyridine-3-carboxamide Openeye Name: 6-(2,3-dimethylphenoxy)-N-[(3R)-2-oxotetrahydrothiophen-3-yl]pyridine-3-carboxamide CAS Name: 6-(2,3-dimethylphenoxy)-N-[(3R)-2-oxo-3-thiolanyl]-3-pyridinecarboxamide IUPAC Name: 6-(2,3-dimethylphenoxy)-N-[(3R)-2-oxothiolan-3-yl]pyridine-3-carboxamide Traditional Name: 6-(2,3-dimethylphenoxy)-N-[(3R)-2-ketotetrahydrothiophen-3-yl]nicotinamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=NC=C(C=C2)C(=O)NC3CCSC3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=NC=C(C=C2)C(=O)N[C@@H]3CCSC3=O)C

InChI

InChI=1S/C18H18N2O3S/c1-11-4-3-5-15(12(11)2)23-16-7-6-13(10-19-16)17(21)20-14-8-9-24-18(14)22/h3-7,10,14H,8-9H2,1-2H3,(H,20,21)/t14-/m1/s1