N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[(4,5-dichloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)thiocarbamoyl]coumarilamide Formula: C17H9Cl2N3O2S2 MolecularWeight: 422.30826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

InChI

InChI=1S/C17H9Cl2N3O2S2/c18-9-5-6-12-14(13(9)19)20-17(26-12)22-16(25)21-15(23)11-7-8-3-1-2-4-10(8)24-11/h1-7H,(H2,20,21,22,23,25)