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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)CC(C)C)CCCOC)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)CC(C)C)CCCOC)C

InChI

InChI=1S/C21H30N2O4S/c1-15(2)14-19(24)22-21-20(28(25,26)18-10-7-6-8-11-18)16(3)17(4)23(21)12-9-13-27-5/h6-8,10-11,15H,9,12-14H2,1-5H3,(H,22,24)