3-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(3-methylsulfanylphenyl)butanamide

Systemtic Name: 3-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(3-methylsulfanylphenyl)butanamide Openeye Name: 3-(1-acetylindolin-5-yl)sulfonyl-N-(3-methylsulfanylphenyl)butanamide CAS Name: 3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-N-[3-(methylthio)phenyl]butanamide IUPAC Name: 3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(3-methylsulfanylphenyl)butanamide Traditional Name: 3-(1-acetylindolin-5-yl)sulfonyl-N-[3-(methylthio)phenyl]butyramide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=CC=C1)SC)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)C

Isomeric SMILES

CC(CC(=O)NC1=CC(=CC=C1)SC)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)C

InChI

InChI=1S/C21H24N2O4S2/c1-14(11-21(25)22-17-5-4-6-18(13-17)28-3)29(26,27)19-7-8-20-16(12-19)9-10-23(20)15(2)24/h4-8,12-14H,9-11H2,1-3H3,(H,22,25)