3,6-bis(chloranyl)-N-[(4-methylpyridin-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(4-methylpyridin-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(4-methyl-2-pyridyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[[(4-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(4-methylpyridin-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(4-methyl-2-pyridyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C16H11Cl2N3OS2 MolecularWeight: 396.31404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=NC=C1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H11Cl2N3OS2/c1-8-4-5-19-12(6-8)20-16(23)21-15(22)14-13(18)10-3-2-9(17)7-11(10)24-14/h2-7H,1H3,(H2,19,20,21,22,23)