N-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-yl-ethyl]acetamide CAS Name: N-[2-(1-methyl-2-pyrrolyl)-2-(1-pyrrolidinyl)ethyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-ylethyl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-[2-(1-methylpyrrol-2-yl)-2-pyrrolidino-ethyl]acetamide Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NCC(C2=CC=CN2C)N3CCCC3

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NCC(C2=CC=CN2C)N3CCCC3

InChI

InChI=1S/C22H31N3OS/c1-17(2)27-19-10-8-18(9-11-19)15-22(26)23-16-21(25-13-4-5-14-25)20-7-6-12-24(20)3/h6-12,17,21H,4-5,13-16H2,1-3H3,(H,23,26)