1-[4-(phenylsulfonyl)-4-prop-2-enylsulfonyl-butyl]indole-3-carbonitrile

Systemtic Name: 1-[4-(phenylsulfonyl)-4-prop-2-enylsulfonyl-butyl]indole-3-carbonitrile Openeye Name: 1-[4-allylsulfonyl-4-(benzenesulfonyl)butyl]indole-3-carbonitrile CAS Name: 1-[4-(benzenesulfonyl)-4-prop-2-enylsulfonylbutyl]-3-indolecarbonitrile IUPAC Name: 1-[4-(benzenesulfonyl)-4-prop-2-enylsulfonylbutyl]indole-3-carbonitrile Traditional Name: 1-(4-allylsulfonyl-4-besyl-butyl)indole-3-carbonitrile Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

C=CCS(=O)(=O)C(CCCN1C=C(C2=CC=CC=C21)C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C=CCS(=O)(=O)C(CCCN1C=C(C2=CC=CC=C21)C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4S2/c1-2-15-29(25,26)22(30(27,28)19-9-4-3-5-10-19)13-8-14-24-17-18(16-23)20-11-6-7-12-21(20)24/h2-7,9-12,17,22H,1,8,13-15H2