N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]pentanamide

Systemtic Name: N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]pentanamide Openeye Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]pentanamide CAS Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]pentanamide IUPAC Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]pentanamide Traditional Name: N-[3-besyl-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]valeramide Formula: C21H30N2O4S MolecularWeight: 406.5389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=C(N1CCCOC)C)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC1=C(C(=C(N1CCCOC)C)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H30N2O4S/c1-5-6-13-19(24)22-21-20(28(25,26)18-11-8-7-9-12-18)16(2)17(3)23(21)14-10-15-27-4/h7-9,11-12H,5-6,10,13-15H2,1-4H3,(H,22,24)