methyl 5-[2-chloranylethanoyl-[(3-methoxythiophen-2-yl)methyl]amino]-1-methyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-[2-chloranylethanoyl-[(3-methoxythiophen-2-yl)methyl]amino]-1-methyl-pyrazole-4-carboxylate Openeye Name: methyl 5-[(2-chloroacetyl)-[(3-methoxy-2-thienyl)methyl]amino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[(2-chloro-1-oxoethyl)-[(3-methoxy-2-thiophenyl)methyl]amino]-1-methyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloroacetyl)-[(3-methoxythiophen-2-yl)methyl]amino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[(2-chloroacetyl)-[(3-methoxy-2-thienyl)methyl]amino]-1-methyl-pyrazole-4-carboxylic acid methyl ester Formula: C14H16ClN3O4S MolecularWeight: 357.81254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)OC)N(CC2=C(C=CS2)OC)C(=O)CCl

Isomeric SMILES

CN1C(=C(C=N1)C(=O)OC)N(CC2=C(C=CS2)OC)C(=O)CCl

InChI

InChI=1S/C14H16ClN3O4S/c1-17-13(9(7-16-17)14(20)22-3)18(12(19)6-15)8-11-10(21-2)4-5-23-11/h4-5,7H,6,8H2,1-3H3