N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(2-furylmethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide CAS Name: N-(2-furanylmethyl)-4-[(4-methoxyphenyl)thio]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(2-furfuryl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C24H24N2O5S3 MolecularWeight: 516.65276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)SCCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C24H24N2O5S3/c1-30-17-10-12-19(13-11-17)32-15-5-9-22(27)26(16-18-6-4-14-31-18)24-25-23-20(33-24)7-3-8-21(23)34(2,28)29/h3-4,6-8,10-14H,5,9,15-16H2,1-2H3