(1-methylpyrrol-2-yl)-[4-(8-thiophen-2-ylquinolin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (1-methylpyrrol-2-yl)-[4-(8-thiophen-2-ylquinolin-2-yl)piperazin-1-yl]methanone Openeye Name: (1-methylpyrrol-2-yl)-[4-[8-(2-thienyl)-2-quinolyl]piperazin-1-yl]methanone CAS Name: (1-methyl-2-pyrrolyl)-[4-(8-thiophen-2-yl-2-quinolinyl)-1-piperazinyl]methanone IUPAC Name: (1-methylpyrrol-2-yl)-[4-(8-thiophen-2-ylquinolin-2-yl)piperazin-1-yl]methanone Traditional Name: (1-methylpyrrol-2-yl)-[4-[8-(2-thienyl)-2-quinolyl]piperazino]methanone Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=CS5)C=C3

Isomeric SMILES

CN1C=CC=C1C(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=CS5)C=C3

InChI

InChI=1S/C23H22N4OS/c1-25-11-3-7-19(25)23(28)27-14-12-26(13-15-27)21-10-9-17-5-2-6-18(22(17)24-21)20-8-4-16-29-20/h2-11,16H,12-15H2,1H3