4-butoxy-N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(3-cyano-4,5-dimethyl-2-thienyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3-cyano-4,5-dimethyl-2-thienyl)thiocarbamoyl]benzamide Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N

InChI

InChI=1S/C19H21N3O2S2/c1-4-5-10-24-15-8-6-14(7-9-15)17(23)21-19(25)22-18-16(11-20)12(2)13(3)26-18/h6-9H,4-5,10H2,1-3H3,(H2,21,22,23,25)