[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C24H25N3O5S2/c1-17-3-5-19(6-4-17)23-25-21(16-33-23)15-32-24(29)20-7-9-22(10-8-20)34(30,31)27-13-11-26(12-14-27)18(2)28/h3-10,16H,11-15H2,1-2H3