N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide

Systemtic Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide Openeye Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide CAS Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonylbenzamide IUPAC Name: N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonylbenzamide Traditional Name: 3-esyl-N-(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)CC)S2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)CC)S2)C

InChI

InChI=1S/C19H20N2O4S2/c1-4-25-14-9-10-16-17(12-14)26-19(21(16)3)20-18(22)13-7-6-8-15(11-13)27(23,24)5-2/h6-12H,4-5H2,1-3H3