2,4-bis(chloranyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[(6-ethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C17H13Cl2N3O2S2 MolecularWeight: 426.34002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2N3O2S2/c1-2-24-10-4-6-13-14(8-10)26-17(20-13)22-16(25)21-15(23)11-5-3-9(18)7-12(11)19/h3-8H,2H2,1H3,(H2,20,21,22,23,25)