2-[[3,5-bis(chloranyl)phenyl]methylsulfanyl]-6-cyclohexyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[3,5-bis(chloranyl)phenyl]methylsulfanyl]-6-cyclohexyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-cyclohexyl-2-[(3,5-dichlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-cyclohexyl-2-[(3,5-dichlorophenyl)methylthio]-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-cyclohexyl-2-[(3,5-dichlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-cyclohexyl-2-[(3,5-dichlorobenzyl)thio]-4-keto-1H-pyrimidine-5-carbonitrile Formula: C18H17Cl2N3OS MolecularWeight: 394.31808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C(=O)N=C(N2)SCC3=CC(=CC(=C3)Cl)Cl)C#N

Isomeric SMILES

C1CCC(CC1)C2=C(C(=O)N=C(N2)SCC3=CC(=CC(=C3)Cl)Cl)C#N

InChI

InChI=1S/C18H17Cl2N3OS/c19-13-6-11(7-14(20)8-13)10-25-18-22-16(12-4-2-1-3-5-12)15(9-21)17(24)23-18/h6-8,12H,1-5,10H2,(H,22,23,24)