4,5-dimethyl-N-[1-[4-(propanoylamino)phenyl]ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-N-[1-[4-(propanoylamino)phenyl]ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-N-[1-[4-(propanoylamino)phenyl]ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide CAS Name: 4,5-dimethyl-N-[1-[4-(1-oxopropylamino)phenyl]ethyl]-2-(1-pyrrolyl)-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-N-[1-[4-(propanoylamino)phenyl]ethyl]-2-pyrrol-1-ylthiophene-3-carboxamide Traditional Name: 4,5-dimethyl-N-[1-(4-propionamidophenyl)ethyl]-2-pyrrol-1-yl-thiophene-3-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=C(SC(=C2C)C)N3C=CC=C3

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=C(SC(=C2C)C)N3C=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-5-19(26)24-18-10-8-17(9-11-18)15(3)23-21(27)20-14(2)16(4)28-22(20)25-12-6-7-13-25/h6-13,15H,5H2,1-4H3,(H,23,27)(H,24,26)