1-[(3-nitrophenyl)methyl]-4-(1,3-thiazol-2-yl)pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 1-[(3-nitrophenyl)methyl]-4-(1,3-thiazol-2-yl)pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 1-[(3-nitrophenyl)methyl]-4-thiazol-2-yl-pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 1-[(3-nitrophenyl)methyl]-4-(2-thiazolyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-[(3-nitrophenyl)methyl]-4-(1,3-thiazol-2-yl)pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: [1-(3-nitrobenzyl)-4-thiazol-2-yl-pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C15H11N7O2S MolecularWeight: 353.35854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C3=NC(=NC(=C3C=N2)C4=NC=CS4)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C3=NC(=NC(=C3C=N2)C4=NC=CS4)N

InChI

InChI=1S/C15H11N7O2S/c16-15-19-12(14-17-4-5-25-14)11-7-18-21(13(11)20-15)8-9-2-1-3-10(6-9)22(23)24/h1-7H,8H2,(H2,16,19,20)