1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide

Systemtic Name: 1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide Openeye Name: 1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide CAS Name: 1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide IUPAC Name: 1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide Traditional Name: 1-[3-(cyanomethyl)-1H-indol-5-yl]-N-[3-(4-methoxyphenyl)propyl]methanesulfonamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCNS(=O)(=O)CC2=CC3=C(C=C2)NC=C3CC#N

Isomeric SMILES

COC1=CC=C(C=C1)CCCNS(=O)(=O)CC2=CC3=C(C=C2)NC=C3CC#N

InChI

InChI=1S/C21H23N3O3S/c1-27-19-7-4-16(5-8-19)3-2-12-24-28(25,26)15-17-6-9-21-20(13-17)18(10-11-22)14-23-21/h4-9,13-14,23-24H,2-3,10,12,15H2,1H3