(1S,2S,3S)-1-cyano-2-pyridin-3-yl-3-thiophen-2-ylcarbonyl-cyclopropane-1-carbothioamide

Systemtic Name: (1S,2S,3S)-1-cyano-2-pyridin-3-yl-3-thiophen-2-ylcarbonyl-cyclopropane-1-carbothioamide Openeye Name: (1S,2S,3S)-1-cyano-2-(3-pyridyl)-3-(thiophene-2-carbonyl)cyclopropanecarbothioamide CAS Name: (1S,2S,3S)-1-cyano-2-[oxo(thiophen-2-yl)methyl]-3-(3-pyridinyl)-1-cyclopropanecarbothioamide IUPAC Name: (1S,2S,3S)-1-cyano-2-pyridin-3-yl-3-(thiophene-2-carbonyl)cyclopropane-1-carbothioamide Traditional Name: (1S,2S,3S)-1-cyano-2-(3-pyridyl)-3-(2-thenoyl)cyclopropanecarbothioamide Formula: C15H11N3OS2 MolecularWeight: 313.39734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2C(C2(C#N)C(=S)N)C(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CN=C1)[C@@H]2[C@@H]([C@@]2(C#N)C(=S)N)C(=O)C3=CC=CS3

InChI

InChI=1S/C15H11N3OS2/c16-8-15(14(17)20)11(9-3-1-5-18-7-9)12(15)13(19)10-4-2-6-21-10/h1-7,11-12H,(H2,17,20)/t11-,12-,15+/m1/s1