1-[[4-cyano-5-(furan-2-yl)-1-phenyl-pyrazol-3-yl]carbonylamino]-3-phenyl-thiourea

Systemtic Name: 1-[[4-cyano-5-(furan-2-yl)-1-phenyl-pyrazol-3-yl]carbonylamino]-3-phenyl-thiourea Openeye Name: 1-[[4-cyano-5-(2-furyl)-1-phenyl-pyrazole-3-carbonyl]amino]-3-phenyl-thiourea CAS Name: 1-[[[4-cyano-5-(2-furanyl)-1-phenyl-3-pyrazolyl]-oxomethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[4-cyano-5-(furan-2-yl)-1-phenylpyrazole-3-carbonyl]amino]-3-phenylthiourea Traditional Name: 1-[[4-cyano-5-(2-furyl)-1-phenyl-pyrazole-3-carbonyl]amino]-3-phenyl-thiourea Formula: C22H16N6O2S MolecularWeight: 428.46644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=NN(C(=C2C#N)C3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=NN(C(=C2C#N)C3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C22H16N6O2S/c23-14-17-19(21(29)25-26-22(31)24-15-8-3-1-4-9-15)27-28(16-10-5-2-6-11-16)20(17)18-12-7-13-30-18/h1-13H,(H,25,29)(H2,24,26,31)