methyl 2-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[3-(4-methylpiperazin-1-yl)sulfonylbenzoyl]amino]thiazole-5-carboxylate CAS Name: 2-[[[3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-(4-methylpiperazin-1-yl)sulfonylbenzoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(4-methylpiperazino)sulfonylbenzoyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C17H20N4O5S2 MolecularWeight: 424.4945

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC=C(S3)C(=O)OC

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC=C(S3)C(=O)OC

InChI

InChI=1S/C17H20N4O5S2/c1-20-6-8-21(9-7-20)28(24,25)13-5-3-4-12(10-13)15(22)19-17-18-11-14(27-17)16(23)26-2/h3-5,10-11H,6-9H2,1-2H3,(H,18,19,22)