1-[(E)-[3-(3-oxidanylidenebenzo[f]chromen-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[3-(3-oxidanylidenebenzo[f]chromen-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: [(E)-[3-(3-oxobenzo[f]chromen-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea CAS Name: [(E)-[3-(3-oxo-2-benzo[f][1]benzopyranyl)-1-phenyl-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: [(E)-[3-(3-oxobenzo[f]chromen-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]thiourea Traditional Name: [(E)-[3-(3-ketobenzo[f]chromen-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea Formula: C24H17N5O2S MolecularWeight: 439.48908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O)C=NNC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O)/C=N/NC(=S)N

InChI

InChI=1S/C24H17N5O2S/c25-24(32)27-26-13-16-14-29(17-7-2-1-3-8-17)28-22(16)20-12-19-18-9-5-4-6-15(18)10-11-21(19)31-23(20)30/h1-14H,(H3,25,27,32)/b26-13+