3-chloranyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[6-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[6-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzothiophene-2-carboxamide Formula: C20H17ClN2O2S3 MolecularWeight: 449.00918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CCSC

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CCSC

InChI

InChI=1S/C20H17ClN2O2S3/c1-25-12-7-8-14-16(11-12)28-20(23(14)9-10-26-2)22-19(24)18-17(21)13-5-3-4-6-15(13)27-18/h3-8,11H,9-10H2,1-2H3