N-(2,6-dimethylphenyl)-2-[4-(3-pyrrol-1-ylthiophen-2-yl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(3-pyrrol-1-ylthiophen-2-yl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(3-pyrrol-1-ylthiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(3-pyrrol-1-ylthiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(3-pyrrol-1-ylthiophene-2-carbonyl)piperazino]acetamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-17-6-5-7-18(2)21(17)24-20(28)16-25-11-13-27(14-12-25)23(29)22-19(8-15-30-22)26-9-3-4-10-26/h3-10,15H,11-14,16H2,1-2H3,(H,24,28)