3-chloranyl-N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[2-(isopentylcarbamothioyl)hydrazino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[[(3-methylbutylamino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[N'-(isoamylthiocarbamoyl)hydrazino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C17H21ClN4O2S2 MolecularWeight: 412.95724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CNC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CNC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C17H21ClN4O2S2/c1-10(2)7-8-19-17(25)22-21-13(23)9-20-16(24)15-14(18)11-5-3-4-6-12(11)26-15/h3-6,10H,7-9H2,1-2H3,(H,20,24)(H,21,23)(H2,19,22,25)