4-chloranyl-2-methylsulfanyl-6-[(phenylmethyl)amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2-methylsulfanyl-6-[(phenylmethyl)amino]pyrimidine-5-carbonitrile Openeye Name: 4-(benzylamino)-6-chloro-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-chloro-2-(methylthio)-6-[(phenylmethyl)amino]-5-pyrimidinecarbonitrile IUPAC Name: 4-(benzylamino)-6-chloro-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(benzylamino)-6-chloro-2-(methylthio)pyrimidine-5-carbonitrile Formula: C13H11ClN4S MolecularWeight: 290.77124

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)Cl)C#N)NCC2=CC=CC=C2

Isomeric SMILES

CSC1=NC(=C(C(=N1)Cl)C#N)NCC2=CC=CC=C2

InChI

InChI=1S/C13H11ClN4S/c1-19-13-17-11(14)10(7-15)12(18-13)16-8-9-5-3-2-4-6-9/h2-6H,8H2,1H3,(H,16,17,18)