2,4-bis(chloranyl)-N-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[(3-cyano-4-ethyl-5-methyl-2-thienyl)carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[(3-cyano-4-ethyl-5-methyl-2-thiophenyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[(3-cyano-4-ethyl-5-methyl-2-thienyl)thiocarbamoyl]benzamide Formula: C16H13Cl2N3OS2 MolecularWeight: 398.32992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C16H13Cl2N3OS2/c1-3-10-8(2)24-15(12(10)7-19)21-16(23)20-14(22)11-5-4-9(17)6-13(11)18/h4-6H,3H2,1-2H3,(H2,20,21,22,23)