N-[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)carbamothioyl]benzamide

Systemtic Name: N-[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)carbamothioyl]benzamide Openeye Name: N-[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)carbamothioyl]benzamide CAS Name: N-[[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)carbamothioyl]benzamide Traditional Name: N-[(3-cyano-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)thiocarbamoyl]benzamide Formula: C18H19N4OS2+ MolecularWeight: 371.49966

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4OS2/c1-2-22-9-8-13-14(10-19)17(25-15(13)11-22)21-18(24)20-16(23)12-6-4-3-5-7-12/h3-7H,2,8-9,11H2,1H3,(H2,20,21,23,24)/p+1