1-[4-(6-methyl-2-thiophen-3-yl-quinolin-4-yl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-(6-methyl-2-thiophen-3-yl-quinolin-4-yl)carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[6-methyl-2-(3-thienyl)quinoline-4-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[6-methyl-2-(3-thiophenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(6-methyl-2-thiophen-3-ylquinoline-4-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-[6-methyl-2-(3-thienyl)quinoline-4-carbonyl]piperazino]ethanone Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C(=O)C)C4=CSC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C(=O)C)C4=CSC=C4

InChI

InChI=1S/C21H21N3O2S/c1-14-3-4-19-17(11-14)18(12-20(22-19)16-5-10-27-13-16)21(26)24-8-6-23(7-9-24)15(2)25/h3-5,10-13H,6-9H2,1-2H3