7-[(3-chlorophenyl)amino]-5-(2-pyrrolidin-1-ylethoxymethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 7-[(3-chlorophenyl)amino]-5-(2-pyrrolidin-1-ylethoxymethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 7-(3-chloroanilino)-5-(2-pyrrolidin-1-ylethoxymethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 7-(3-chloroanilino)-5-[2-(1-pyrrolidinyl)ethoxymethyl]-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 7-(3-chloroanilino)-5-(2-pyrrolidin-1-ylethoxymethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 7-(3-chloroanilino)-5-(2-pyrrolidinoethoxymethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C20H21ClN6O MolecularWeight: 396.87334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOCC2=NC3=C(C=NN3C(=C2)NC4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

C1CCN(C1)CCOCC2=NC3=C(C=NN3C(=C2)NC4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C20H21ClN6O/c21-16-4-3-5-17(10-16)24-19-11-18(14-28-9-8-26-6-1-2-7-26)25-20-15(12-22)13-23-27(19)20/h3-5,10-11,13,24H,1-2,6-9,14H2