2-(4-methylphenyl)-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-(4-methylphenyl)-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-thiazole Openeye Name: 4-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]-2-(p-tolyl)thiazole CAS Name: 2-(4-methylphenyl)-4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]thiazole IUPAC Name: 2-(4-methylphenyl)-4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-1,3-thiazole Traditional Name: 4-[[4-(6-nitro-3-pyridyl)piperazino]methyl]-2-(p-tolyl)thiazole Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O2S/c1-15-2-4-16(5-3-15)20-22-17(14-28-20)13-23-8-10-24(11-9-23)18-6-7-19(21-12-18)25(26)27/h2-7,12,14H,8-11,13H2,1H3