2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Openeye Name: 2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]thiazole CAS Name: 2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methyl]thiazole IUPAC Name: 2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Traditional Name: 2-(4-methoxyphenyl)-4-[[4-(3-nitrophenyl)sulfonylpiperazino]methyl]thiazole Formula: C21H22N4O5S2 MolecularWeight: 474.55318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O5S2/c1-30-19-7-5-16(6-8-19)21-22-17(15-31-21)14-23-9-11-24(12-10-23)32(28,29)20-4-2-3-18(13-20)25(26)27/h2-8,13,15H,9-12,14H2,1H3