2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(1-benzylpyrazol-4-yl)methyl-methylamino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H27N5O2S/c1-25(15-20-14-24-28(17-20)16-19-6-3-2-4-7-19)18-22(29)26-9-11-27(12-10-26)23(30)21-8-5-13-31-21/h2-8,13-14,17H,9-12,15-16,18H2,1H3