N-(3-cyclohexylsulfanylpropyl)-2-[2-(2-methylphenyl)carbonylpyrrol-1-yl]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[2-(2-methylphenyl)carbonylpyrrol-1-yl]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-[2-(2-methylbenzoyl)pyrrol-1-yl]acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-[2-[(2-methylphenyl)-oxomethyl]-1-pyrrolyl]acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-[2-(2-methylbenzoyl)pyrrol-1-yl]acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(2-o-toluoylpyrrol-1-yl)acetamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CC=CN2CC(=O)NCCCSC3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CC=CN2CC(=O)NCCCSC3CCCCC3

InChI

InChI=1S/C23H30N2O2S/c1-18-9-5-6-12-20(18)23(27)21-13-7-15-25(21)17-22(26)24-14-8-16-28-19-10-3-2-4-11-19/h5-7,9,12-13,15,19H,2-4,8,10-11,14,16-17H2,1H3,(H,24,26)