2-[4-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonylpiperazin-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonylpiperazin-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-oxomethyl]-1-piperazinyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-(4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carbonyl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)piperazino]-N-(3-fluorophenyl)acetamide Formula: C23H25FN4O2S MolecularWeight: 440.533603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)F)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)F)N4C=CC=C4)C

InChI

InChI=1S/C23H25FN4O2S/c1-16-17(2)31-23(28-8-3-4-9-28)21(16)22(30)27-12-10-26(11-13-27)15-20(29)25-19-7-5-6-18(24)14-19/h3-9,14H,10-13,15H2,1-2H3,(H,25,29)