1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(8-quinolylmethyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(8-quinolinylmethyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-4-[4-(8-quinolylmethyl)piperazino]butane-1,4-dione Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H29N5O2/c33-25(11-12-26(34)32-15-13-24(29-32)21-6-2-1-3-7-21)31-18-16-30(17-19-31)20-23-9-4-8-22-10-5-14-28-27(22)23/h1-10,14H,11-13,15-20H2