methyl 4-[2-[2-[(4-pyridin-2-ylpiperazin-1-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-[(4-pyridin-2-ylpiperazin-1-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-[[4-(2-pyridyl)piperazine-1-carbonyl]amino]thiazol-4-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-[[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]amino]-4-thiazolyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-[(4-pyridin-2-ylpiperazine-1-carbonyl)amino]-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-[[4-(2-pyridyl)piperazine-1-carbonyl]amino]thiazol-4-yl]acetyl]amino]benzoic acid methyl ester Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H24N6O4S/c1-33-21(31)16-5-7-17(8-6-16)25-20(30)14-18-15-34-22(26-18)27-23(32)29-12-10-28(11-13-29)19-4-2-3-9-24-19/h2-9,15H,10-14H2,1H3,(H,25,30)(H,26,27,32)