1-butyl-3-[(Z)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]thiourea Openeye Name: 1-butyl-3-[(Z)-(2,4-dimethyl-5-oxo-1-phenyl-pyrazol-3-yl)methyleneamino]thiourea CAS Name: 1-butyl-3-[(Z)-(2,4-dimethyl-5-oxo-1-phenyl-3-pyrazolyl)methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(Z)-(2,4-dimethyl-5-oxo-1-phenylpyrazol-3-yl)methylideneamino]thiourea Traditional Name: 1-butyl-3-[(Z)-(5-keto-2,4-dimethyl-1-phenyl-3-pyrazolin-3-yl)methyleneamino]thiourea Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCCNC(=S)N/N=C\C1=C(C(=O)N(N1C)C2=CC=CC=C2)C

InChI

InChI=1S/C17H23N5OS/c1-4-5-11-18-17(24)20-19-12-15-13(2)16(23)22(21(15)3)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3,(H2,18,20,24)/b19-12-