4-[(2,4-dichlorophenyl)amino]-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(2,4-dichloroanilino)-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(2,4-dichloroanilino)-6-(methylthio)-2-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(2,4-dichloroanilino)-6-methylsulfanyl-2-phenylpyrimidine-5-carbonitrile Traditional Name: 4-(2,4-dichloroanilino)-6-(methylthio)-2-phenyl-pyrimidine-5-carbonitrile Formula: C18H12Cl2N4S MolecularWeight: 387.28568

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)NC2=C(C=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)NC2=C(C=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H12Cl2N4S/c1-25-18-13(10-21)17(22-15-8-7-12(19)9-14(15)20)23-16(24-18)11-5-3-2-4-6-11/h2-9H,1H3,(H,22,23,24)