1,5-dimethyl-2-phenyl-4-[(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]pyrazol-3-one

Systemtic Name: 1,5-dimethyl-2-phenyl-4-[(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]pyrazol-3-one Openeye Name: 1,5-dimethyl-2-phenyl-4-[[5-(2-pyridylsulfanyl)-2-furyl]methyleneamino]pyrazol-3-one CAS Name: 1,5-dimethyl-2-phenyl-4-[[5-(2-pyridinylthio)-2-furanyl]methylideneamino]-3-pyrazolone IUPAC Name: 1,5-dimethyl-2-phenyl-4-[(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]pyrazol-3-one Traditional Name: 1,5-dimethyl-2-phenyl-4-[[5-(2-pyridylthio)-2-furyl]methyleneamino]-3-pyrazolin-3-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)SC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=C(O3)SC4=CC=CC=N4

InChI

InChI=1S/C21H18N4O2S/c1-15-20(21(26)25(24(15)2)16-8-4-3-5-9-16)23-14-17-11-12-19(27-17)28-18-10-6-7-13-22-18/h3-14H,1-2H3