3-cyclopropyl-5-methylsulfanyl-7-[(phenylmethyl)amino]pyrazolo[1,5-a]pyrimidine-6-carbonitrile

Systemtic Name: 3-cyclopropyl-5-methylsulfanyl-7-[(phenylmethyl)amino]pyrazolo[1,5-a]pyrimidine-6-carbonitrile Openeye Name: 7-(benzylamino)-3-cyclopropyl-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidine-6-carbonitrile CAS Name: 3-cyclopropyl-5-(methylthio)-7-[(phenylmethyl)amino]-6-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 7-(benzylamino)-3-cyclopropyl-5-methylsulfanylpyrazolo[1,5-a]pyrimidine-6-carbonitrile Traditional Name: 7-(benzylamino)-3-cyclopropyl-5-(methylthio)pyrazolo[1,5-a]pyrimidine-6-carbonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2C(=C1C#N)NCC3=CC=CC=C3)C4CC4

Isomeric SMILES

CSC1=NC2=C(C=NN2C(=C1C#N)NCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C18H17N5S/c1-24-18-14(9-19)16(20-10-12-5-3-2-4-6-12)23-17(22-18)15(11-21-23)13-7-8-13/h2-6,11,13,20H,7-8,10H2,1H3