3-chloranyl-N-[(phenylcarbamothioylamino)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(phenylcarbamothioylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(phenylcarbamothioylamino)carbamothioyl]benzothiophene-2-carboxamide CAS Name: N-[[[anilino(sulfanylidene)methyl]hydrazo]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(phenylcarbamothioylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(phenylthiocarbamoylamino)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H13ClN4OS3 MolecularWeight: 420.95932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClN4OS3/c18-13-11-8-4-5-9-12(11)26-14(13)15(23)20-17(25)22-21-16(24)19-10-6-2-1-3-7-10/h1-9H,(H2,19,21,24)(H2,20,22,23,25)