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

Systemtic Name: N-(7-chloranyl-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonyl-benzamide Openeye Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonyl-benzamide CAS Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonylbenzamide IUPAC Name: N-(7-chloro-4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonylbenzamide Traditional Name: N-(7-chloro-4-methyl-3-propargyl-1,3-benzothiazol-2-ylidene)-2-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=C3S(=O)(=O)C)N2CC#C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC=CC=C3S(=O)(=O)C)N2CC#C

InChI

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