N-(7-chloranyl-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide

Systemtic Name: N-(7-chloranyl-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide Openeye Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide CAS Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonylbenzamide IUPAC Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonylbenzamide Traditional Name: N-(7-chloro-4-methyl-3-propargyl-1,3-benzothiazol-2-ylidene)-3-mesyl-benzamide Formula: C19H15ClN2O3S2 MolecularWeight: 418.917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)N2CC#C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)N2CC#C

InChI

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