2-(4-ethylsulfanylphenyl)-N-(furan-2-ylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(4-ethylsulfanylphenyl)-N-(furan-2-ylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-ethylsulfanylphenyl)-N-(2-furylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[4-(ethylthio)phenyl]-N-(2-furanylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-ethylsulfanylphenyl)-N-(furan-2-ylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[4-(ethylthio)phenyl]-N-(2-furfuryl)-N-(4-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C23H22N2O4S3 MolecularWeight: 486.62678

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=C(C=C1)CC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C23H22N2O4S3/c1-3-30-18-11-9-16(10-12-18)14-21(26)25(15-17-6-5-13-29-17)23-24-22-19(31-23)7-4-8-20(22)32(2,27)28/h4-13H,3,14-15H2,1-2H3