1-(furan-2-ylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-4-yl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: 1-(2-furylmethyl)-3-[(Z)-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-(2-furanylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)methylideneamino]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-(2-furfuryl)-3-[(Z)-[1-phenyl-3-(4-pyridyl)pyrazol-4-yl]methyleneamino]thiourea Formula: C21H18N6OS MolecularWeight: 402.47222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)C=NNC(=S)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=NC=C3)/C=N\NC(=S)NCC4=CC=CO4

InChI

InChI=1S/C21H18N6OS/c29-21(23-14-19-7-4-12-28-19)25-24-13-17-15-27(18-5-2-1-3-6-18)26-20(17)16-8-10-22-11-9-16/h1-13,15H,14H2,(H2,23,25,29)/b24-13-