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

Systemtic Name: S-prop-2-enyl 5-azanyl-4-[2,6-bis(chloranyl)phenyl]-3-oxidanylidene-2-propan-2-yl-pyrazole-1-carbothioate Openeye Name: S-allyl 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-prop-2-enyl ester IUPAC Name: S-prop-2-enyl 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-allyl ester Formula: C16H17Cl2N3O2S MolecularWeight: 386.29608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17Cl2N3O2S/c1-4-8-24-16(23)21-14(19)13(15(22)20(21)9(2)3)12-10(17)6-5-7-11(12)18/h4-7,9H,1,8,19H2,2-3H3