N-(6-chloranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylsulfonyl-benzamide

Systemtic Name: N-(6-chloranyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylsulfonyl-benzamide Openeye Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylsulfonyl-benzamide CAS Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylsulfonylbenzamide IUPAC Name: N-(6-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-ethylsulfonylbenzamide Traditional Name: N-(6-chloro-3-propargyl-1,3-benzothiazol-2-ylidene)-2-esyl-benzamide Formula: C19H15ClN2O3S2 MolecularWeight: 418.917

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)Cl)CC#C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)Cl)CC#C

InChI

InChI=1S/C19H15ClN2O3S2/c1-3-11-22-15-10-9-13(20)12-16(15)26-19(22)21-18(23)14-7-5-6-8-17(14)27(24,25)4-2/h1,5-10,12H,4,11H2,2H3