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

Systemtic Name: 5-chloranyl-N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide CAS Name: 5-chloro-N-[6-ethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[6-ethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]thiophene-2-carboxamide Formula: C17H17ClN2O2S3 MolecularWeight: 412.97708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(S3)Cl)S2)CCSC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(S3)Cl)S2)CCSC

InChI

InChI=1S/C17H17ClN2O2S3/c1-3-22-11-4-5-12-14(10-11)25-17(20(12)8-9-23-2)19-16(21)13-6-7-15(18)24-13/h4-7,10H,3,8-9H2,1-2H3