N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: 2-benzylsulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)acetamide CAS Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: 2-benzylsulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-benzylsulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC3=CC=CC=C3)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC3=CC=CC=C3)S2)C

InChI

InChI=1S/C18H18N2O3S2/c1-13-8-9-15-16(10-13)24-18(20(15)2)19-17(21)12-25(22,23)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3