S-ethyl 5-azanyl-4-[2,6-bis(chloranyl)phenyl]-3-oxidanylidene-2-propan-2-yl-pyrazole-1-carbothioate

Systemtic Name: S-ethyl 5-azanyl-4-[2,6-bis(chloranyl)phenyl]-3-oxidanylidene-2-propan-2-yl-pyrazole-1-carbothioate Openeye Name: S-ethyl 5-amino-4-(2,6-dichlorophenyl)-2-isopropyl-3-oxo-pyrazole-1-carbothioate CAS Name: 5-amino-4-(2,6-dichlorophenyl)-3-oxo-2-propan-2-yl-1-pyrazolecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 5-amino-4-(2,6-dichlorophenyl)-3-oxo-2-propan-2-ylpyrazole-1-carbothioate Traditional Name: 5-amino-4-(2,6-dichlorophenyl)-2-isopropyl-3-keto-3-pyrazoline-1-carbothioic acid S-ethyl ester Formula: C15H17Cl2N3O2S MolecularWeight: 374.28538

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)N1C(=C(C(=O)N1C(C)C)C2=C(C=CC=C2Cl)Cl)N

Isomeric SMILES

CCSC(=O)N1C(=C(C(=O)N1C(C)C)C2=C(C=CC=C2Cl)Cl)N

InChI

InChI=1S/C15H17Cl2N3O2S/c1-4-23-15(22)20-13(18)12(14(21)19(20)8(2)3)11-9(16)6-5-7-10(11)17/h5-8H,4,18H2,1-3H3