2-azanyl-4-[5-[bis(fluoranyl)methyl]furan-2-yl]-6-(2-pyridin-2-ylethylsulfanyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[5-[bis(fluoranyl)methyl]furan-2-yl]-6-(2-pyridin-2-ylethylsulfanyl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[5-(difluoromethyl)-2-furyl]-6-[2-(2-pyridyl)ethylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[5-(difluoromethyl)-2-furanyl]-6-[2-(2-pyridinyl)ethylthio]-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[5-(difluoromethyl)furan-2-yl]-6-(2-pyridin-2-ylethylsulfanyl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[5-(difluoromethyl)-2-furyl]-6-[2-(2-pyridyl)ethylthio]pyrimidine-5-carbonitrile Formula: C17H13F2N5OS MolecularWeight: 373.379826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCSC2=NC(=NC(=C2C#N)C3=CC=C(O3)C(F)F)N

Isomeric SMILES

C1=CC=NC(=C1)CCSC2=NC(=NC(=C2C#N)C3=CC=C(O3)C(F)F)N

InChI

InChI=1S/C17H13F2N5OS/c18-15(19)13-5-4-12(25-13)14-11(9-20)16(24-17(21)23-14)26-8-6-10-3-1-2-7-22-10/h1-5,7,15H,6,8H2,(H2,21,23,24)