ethyl 4-azanyl-2-[2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-(4-chlorobenzoyl)hydrazino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[[(4-chlorophenyl)-oxomethyl]hydrazo]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[N'-(4-chlorobenzoyl)hydrazino]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C16H16ClN5O4S MolecularWeight: 409.84734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClN5O4S/c1-2-26-15(25)11-7-19-16(20-13(11)18)27-8-12(23)21-22-14(24)9-3-5-10(17)6-4-9/h3-7H,2,8H2,1H3,(H,21,23)(H,22,24)(H2,18,19,20)