3-(4-methylpiperazin-1-yl)propyl 5-chloranyl-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: 3-(4-methylpiperazin-1-yl)propyl 5-chloranyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: 3-(4-methylpiperazin-1-yl)propyl 5-chloro-3-methyl-isothiazole-4-carboxylate CAS Name: 5-chloro-3-methyl-4-isothiazolecarboxylic acid 3-(4-methyl-1-piperazinyl)propyl ester IUPAC Name: 3-(4-methylpiperazin-1-yl)propyl 5-chloro-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-isothiazole-4-carboxylic acid 3-(4-methylpiperazino)propyl ester Formula: C13H20ClN3O2S MolecularWeight: 317.8348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCCCN2CCN(CC2)C)Cl

Isomeric SMILES

CC1=NSC(=C1C(=O)OCCCN2CCN(CC2)C)Cl

InChI

InChI=1S/C13H20ClN3O2S/c1-10-11(12(14)20-15-10)13(18)19-9-3-4-17-7-5-16(2)6-8-17/h3-9H2,1-2H3