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

Systemtic Name: 3-chloranyl-N-[(pyridin-3-ylcarbonylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(pyridine-3-carbonylamino)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[oxo(3-pyridinyl)methyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(pyridine-3-carbonylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(nicotinamidothiocarbamoyl)benzothiophene-2-carboxamide Formula: C16H11ClN4O2S2 MolecularWeight: 390.86714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CN=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CN=CC=C3)Cl

InChI

InChI=1S/C16H11ClN4O2S2/c17-12-10-5-1-2-6-11(10)25-13(12)15(23)19-16(24)21-20-14(22)9-4-3-7-18-8-9/h1-8H,(H,20,22)(H2,19,21,23,24)