5-[(3S)-3-azanylpyrrolidin-1-yl]-3-phenylsulfanyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-[(3S)-3-azanylpyrrolidin-1-yl]-3-phenylsulfanyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-[(3S)-3-aminopyrrolidin-1-yl]-3-phenylsulfanyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-[(3S)-3-amino-1-pyrrolidinyl]-3-(phenylthio)-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-[(3S)-3-aminopyrrolidin-1-yl]-3-phenylsulfanylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [(3S)-1-[7-amino-3-(phenylthio)pyrazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-3-yl]amine Formula: C16H18N6S MolecularWeight: 326.41932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=NC3=C(C=NN3C(=C2)N)SC4=CC=CC=C4

Isomeric SMILES

C1CN(C[C@H]1N)C2=NC3=C(C=NN3C(=C2)N)SC4=CC=CC=C4

InChI

InChI=1S/C16H18N6S/c17-11-6-7-21(10-11)15-8-14(18)22-16(20-15)13(9-19-22)23-12-4-2-1-3-5-12/h1-5,8-9,11H,6-7,10,17-18H2/t11-/m0/s1