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

Systemtic Name: 3-chloranyl-N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(6-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide Formula: C20H13ClN2O2S2 MolecularWeight: 412.91242

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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)CC#C

Isomeric SMILES

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

InChI

InChI=1S/C20H13ClN2O2S2/c1-3-10-23-14-9-8-12(25-2)11-16(14)27-20(23)22-19(24)18-17(21)13-6-4-5-7-15(13)26-18/h1,4-9,11H,10H2,2H3