4-[1-(4-methylphenyl)sulfonylindol-3-yl]-N-[(1S,2S)-2-oxidanylcyclohexyl]butanamide

Systemtic Name: 4-[1-(4-methylphenyl)sulfonylindol-3-yl]-N-[(1S,2S)-2-oxidanylcyclohexyl]butanamide Openeye Name: N-[(1S,2S)-2-hydroxycyclohexyl]-4-[1-(p-tolylsulfonyl)indol-3-yl]butanamide CAS Name: N-[(1S,2S)-2-hydroxycyclohexyl]-4-[1-(4-methylphenyl)sulfonyl-3-indolyl]butanamide IUPAC Name: N-[(1S,2S)-2-hydroxycyclohexyl]-4-[1-(4-methylphenyl)sulfonylindol-3-yl]butanamide Traditional Name: N-[(1S,2S)-2-hydroxycyclohexyl]-4-(1-tosylindol-3-yl)butyramide Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)NC4CCCCC4O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)N[C@H]4CCCC[C@@H]4O

InChI

InChI=1S/C25H30N2O4S/c1-18-13-15-20(16-14-18)32(30,31)27-17-19(21-8-2-4-10-23(21)27)7-6-12-25(29)26-22-9-3-5-11-24(22)28/h2,4,8,10,13-17,22,24,28H,3,5-7,9,11-12H2,1H3,(H,26,29)/t22-,24-/m0/s1