1-ethyl-2-[1-[2-(phenylsulfonyl)ethanoyl]pyrrolidin-2-yl]indole-6-carbonitrile

Systemtic Name: 1-ethyl-2-[1-[2-(phenylsulfonyl)ethanoyl]pyrrolidin-2-yl]indole-6-carbonitrile Openeye Name: 2-[1-[2-(benzenesulfonyl)acetyl]pyrrolidin-2-yl]-1-ethyl-indole-6-carbonitrile CAS Name: 2-[1-[2-(benzenesulfonyl)-1-oxoethyl]-2-pyrrolidinyl]-1-ethyl-6-indolecarbonitrile IUPAC Name: 2-[1-[2-(benzenesulfonyl)acetyl]pyrrolidin-2-yl]-1-ethylindole-6-carbonitrile Traditional Name: 2-[1-(2-besylacetyl)pyrrolidin-2-yl]-1-ethyl-indole-6-carbonitrile Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C#N)C3CCCN3C(=O)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C#N)C3CCCN3C(=O)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3S/c1-2-25-21-13-17(15-24)10-11-18(21)14-22(25)20-9-6-12-26(20)23(27)16-30(28,29)19-7-4-3-5-8-19/h3-5,7-8,10-11,13-14,20H,2,6,9,12,16H2,1H3