methyl 6-[2-[(2-methoxy-2-oxidanylidene-ethyl)carbamothioyl]pyrazolidin-1-yl]carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-[2-[(2-methoxy-2-oxidanylidene-ethyl)carbamothioyl]pyrazolidin-1-yl]carbonylpyridine-3-carboxylate Openeye Name: methyl 6-[2-[(2-methoxy-2-oxo-ethyl)carbamothioyl]pyrazolidine-1-carbonyl]pyridine-3-carboxylate CAS Name: 6-[[2-[[(2-methoxy-2-oxoethyl)amino]-sulfanylidenemethyl]-1-pyrazolidinyl]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-[(2-methoxy-2-oxoethyl)carbamothioyl]pyrazolidine-1-carbonyl]pyridine-3-carboxylate Traditional Name: 6-[2-[(2-keto-2-methoxy-ethyl)thiocarbamoyl]pyrazolidine-1-carbonyl]nicotinic acid methyl ester Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)N1CCCN1C(=O)C2=NC=C(C=C2)C(=O)OC

Isomeric SMILES

COC(=O)CNC(=S)N1CCCN1C(=O)C2=NC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H18N4O5S/c1-23-12(20)9-17-15(25)19-7-3-6-18(19)13(21)11-5-4-10(8-16-11)14(22)24-2/h4-5,8H,3,6-7,9H2,1-2H3,(H,17,25)