N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-methylsulfonyl-benzamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-methylsulfonyl-benzamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-methylsulfonyl-benzamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-methylsulfonylbenzamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-methylsulfonylbenzamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-mesyl-benzamide Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C22H20N2O4S2/c1-3-15-9-10-19-20(12-15)29-22(23-19)24(14-17-7-5-11-28-17)21(25)16-6-4-8-18(13-16)30(2,26)27/h4-13H,3,14H2,1-2H3