1-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]urea

Systemtic Name: 1-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]urea Openeye Name: [(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]urea CAS Name: [(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylideneamino]urea IUPAC Name: [(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylideneamino]urea Traditional Name: [(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]urea Formula: C19H17N5O3 MolecularWeight: 363.36998

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=NNC(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=N/NC(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C19H17N5O3/c20-19(25)22-21-11-14-12-24(15-4-2-1-3-5-15)23-18(14)13-6-7-16-17(10-13)27-9-8-26-16/h1-7,10-12H,8-9H2,(H3,20,22,25)/b21-11+