N-[6-cyano-7-[(3-cyanophenyl)amino]-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-yl]ethanamide

Systemtic Name: N-[6-cyano-7-[(3-cyanophenyl)amino]-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-yl]ethanamide Openeye Name: N-[6-cyano-7-(3-cyanoanilino)-5-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-yl]acetamide CAS Name: N-[6-cyano-7-(3-cyanoanilino)-5-(methylthio)-3-pyrazolo[1,5-a]pyrimidinyl]acetamide IUPAC Name: N-[6-cyano-7-(3-cyanoanilino)-5-methylsulfanylpyrazolo[1,5-a]pyrimidin-3-yl]acetamide Traditional Name: N-[6-cyano-7-(3-cyanoanilino)-5-(methylthio)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide Formula: C17H13N7OS MolecularWeight: 363.39642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2N=C(C(=C(N2N=C1)NC3=CC=CC(=C3)C#N)C#N)SC

Isomeric SMILES

CC(=O)NC1=C2N=C(C(=C(N2N=C1)NC3=CC=CC(=C3)C#N)C#N)SC

InChI

InChI=1S/C17H13N7OS/c1-10(25)21-14-9-20-24-15(13(8-19)17(26-2)23-16(14)24)22-12-5-3-4-11(6-12)7-18/h3-6,9,22H,1-2H3,(H,21,25)