2-azanyl-4-cyclopentylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-cyclopentylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-cyclopentylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(cyclopentylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-cyclopentylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(cyclopentylthio)-6-phenyl-pyrimidine-5-carbonitrile Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=NC(=NC(=C2C#N)C3=CC=CC=C3)N

Isomeric SMILES

C1CCC(C1)SC2=NC(=NC(=C2C#N)C3=CC=CC=C3)N

InChI

InChI=1S/C16H16N4S/c17-10-13-14(11-6-2-1-3-7-11)19-16(18)20-15(13)21-12-8-4-5-9-12/h1-3,6-7,12H,4-5,8-9H2,(H2,18,19,20)