4-(4-chlorophenyl)-2-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-(methylthio)-6-(1-pyrrolidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-methylsulfanyl-6-pyrrolidin-1-ylpyrimidine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-(methylthio)-6-pyrrolidino-pyrimidine-5-carbonitrile Formula: C16H15ClN4S MolecularWeight: 330.8351

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)N2CCCC2)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC(=C(C(=N1)N2CCCC2)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN4S/c1-22-16-19-14(11-4-6-12(17)7-5-11)13(10-18)15(20-16)21-8-2-3-9-21/h4-7H,2-3,8-9H2,1H3