N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-4-ethylsulfonyl-benzamide

Systemtic Name: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-4-ethylsulfonyl-benzamide Openeye Name: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-4-ethylsulfonyl-benzamide CAS Name: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-4-ethylsulfonylbenzamide IUPAC Name: N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-4-ethylsulfonylbenzamide Traditional Name: 4-esyl-N-[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]benzamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)CC

Isomeric SMILES

CCOCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)CC

InChI

InChI=1S/C20H22N2O4S2/c1-3-26-14-13-22-17-7-5-6-8-18(17)27-20(22)21-19(23)15-9-11-16(12-10-15)28(24,25)4-2/h5-12H,3-4,13-14H2,1-2H3