4-azanyl-2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(3-p-cumenyl-1,2,4-oxadiazol-5-yl)methylthio]pyrimidine-5-carbonitrile Formula: C17H16N6OS MolecularWeight: 352.41354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C17H16N6OS/c1-10(2)11-3-5-12(6-4-11)16-21-14(24-23-16)9-25-17-20-8-13(7-18)15(19)22-17/h3-6,8,10H,9H2,1-2H3,(H2,19,20,22)