3-chloranyl-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(6-ethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide Formula: C21H15ClN2O2S2 MolecularWeight: 426.939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CC#C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CC#C

InChI

InChI=1S/C21H15ClN2O2S2/c1-3-11-24-15-10-9-13(26-4-2)12-17(15)28-21(24)23-20(25)19-18(22)14-7-5-6-8-16(14)27-19/h1,5-10,12H,4,11H2,2H3