3-methyl-1-(phenylsulfonyl)-4-(pyrrolidin-1-ylmethyl)indole

Systemtic Name: 3-methyl-1-(phenylsulfonyl)-4-(pyrrolidin-1-ylmethyl)indole Openeye Name: 1-(benzenesulfonyl)-3-methyl-4-(pyrrolidin-1-ylmethyl)indole CAS Name: 1-(benzenesulfonyl)-3-methyl-4-(1-pyrrolidinylmethyl)indole IUPAC Name: 1-(benzenesulfonyl)-3-methyl-4-(pyrrolidin-1-ylmethyl)indole Traditional Name: 1-besyl-3-methyl-4-(pyrrolidinomethyl)indole Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC(=C12)CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CN(C2=CC=CC(=C12)CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H22N2O2S/c1-16-14-22(25(23,24)18-9-3-2-4-10-18)19-11-7-8-17(20(16)19)15-21-12-5-6-13-21/h2-4,7-11,14H,5-6,12-13,15H2,1H3