N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]ethanamide Openeye Name: N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]acetamide CAS Name: N-(2-methoxyethyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[[[4-(methylthio)anilino]-oxomethyl]-propylamino]acetamide IUPAC Name: N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propylamino]acetamide Traditional Name: N-(2-methoxyethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[[4-(methylthio)phenyl]carbamoyl-propyl-amino]acetamide Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CCOC)CC1=CC=CN1C)C(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CCCN(CC(=O)N(CCOC)CC1=CC=CN1C)C(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C22H32N4O3S/c1-5-12-26(22(28)23-18-8-10-20(30-4)11-9-18)17-21(27)25(14-15-29-3)16-19-7-6-13-24(19)2/h6-11,13H,5,12,14-17H2,1-4H3,(H,23,28)