3-chloranyl-N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[5,6-dimethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5,6-dimethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzothiophene-2-carboxamide Formula: C21H19ClN2OS3 MolecularWeight: 447.03636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)N2CCSC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)N2CCSC

InChI

InChI=1S/C21H19ClN2OS3/c1-12-10-15-17(11-13(12)2)28-21(24(15)8-9-26-3)23-20(25)19-18(22)14-6-4-5-7-16(14)27-19/h4-7,10-11H,8-9H2,1-3H3