N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylsulfanyl-N-(2-thiophen-2-ylethyl)butanamide

Systemtic Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylsulfanyl-N-(2-thiophen-2-ylethyl)butanamide Openeye Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylsulfanyl-N-[2-(2-thienyl)ethyl]butanamide CAS Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-(phenylthio)-N-(2-thiophen-2-ylethyl)butanamide IUPAC Name: N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-4-phenylsulfanyl-N-(2-thiophen-2-ylethyl)butanamide Traditional Name: N-(4-mesyl-1,3-benzothiazol-2-yl)-4-(phenylthio)-N-[2-(2-thienyl)ethyl]butyramide Formula: C24H24N2O3S4 MolecularWeight: 516.71896

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CCCSC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CCCSC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3S4/c1-33(28,29)21-12-5-11-20-23(21)25-24(32-20)26(15-14-19-10-6-16-31-19)22(27)13-7-17-30-18-8-3-2-4-9-18/h2-6,8-12,16H,7,13-15,17H2,1H3