1-[(E)-(3-methyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-(3-methyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-(3-methyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-(3-methyl-5-phenoxy-1-phenyl-4-pyrazolyl)methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-(3-methyl-5-phenoxy-1-phenylpyrazol-4-yl)methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-(3-methyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyleneamino]-3-phenyl-thiourea Formula: C24H21N5OS MolecularWeight: 427.52144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=S)NC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5OS/c1-18-22(17-25-27-24(31)26-19-11-5-2-6-12-19)23(30-21-15-9-4-10-16-21)29(28-18)20-13-7-3-8-14-20/h2-17H,1H3,(H2,26,27,31)/b25-17+