N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-ethylsulfonyl-benzamide

Systemtic Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-ethylsulfonyl-benzamide Openeye Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-ethylsulfonyl-benzamide CAS Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-ethylsulfonylbenzamide IUPAC Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-ethylsulfonylbenzamide Traditional Name: 4-esyl-N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)CC)S2)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)CC)S2)C

InChI

InChI=1S/C19H20N2O3S2/c1-4-13-6-11-16-17(12-13)25-19(21(16)3)20-18(22)14-7-9-15(10-8-14)26(23,24)5-2/h6-12H,4-5H2,1-3H3