N-(3-cyclohexylsulfanylpropyl)-2-[2-(phenylcarbonyl)pyrrol-1-yl]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[2-(phenylcarbonyl)pyrrol-1-yl]ethanamide Openeye Name: 2-(2-benzoylpyrrol-1-yl)-N-(3-cyclohexylsulfanylpropyl)acetamide CAS Name: 2-(2-benzoyl-1-pyrrolyl)-N-[3-(cyclohexylthio)propyl]acetamide IUPAC Name: 2-(2-benzoylpyrrol-1-yl)-N-(3-cyclohexylsulfanylpropyl)acetamide Traditional Name: 2-(2-benzoylpyrrol-1-yl)-N-[3-(cyclohexylthio)propyl]acetamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCCNC(=O)CN2C=CC=C2C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)SCCCNC(=O)CN2C=CC=C2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2S/c25-21(23-14-8-16-27-19-11-5-2-6-12-19)17-24-15-7-13-20(24)22(26)18-9-3-1-4-10-18/h1,3-4,7,9-10,13,15,19H,2,5-6,8,11-12,14,16-17H2,(H,23,25)