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

Systemtic Name: 1-[(Z)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[(Z)-(2,4-dimethyl-5-oxo-1-phenyl-pyrazol-3-yl)methyleneamino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[(Z)-(2,4-dimethyl-5-oxo-1-phenyl-3-pyrazolyl)methylideneamino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[(Z)-(2,4-dimethyl-5-oxo-1-phenylpyrazol-3-yl)methylideneamino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-(3-ethoxypropyl)-3-[(Z)-(5-keto-2,4-dimethyl-1-phenyl-3-pyrazolin-3-yl)methyleneamino]thiourea Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O2S/c1-4-25-12-8-11-19-18(26)21-20-13-16-14(2)17(24)23(22(16)3)15-9-6-5-7-10-15/h5-7,9-10,13H,4,8,11-12H2,1-3H3,(H2,19,21,26)/b20-13-