6-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-methyl-N-[(3-nitrophenyl)methyl]-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-methyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-(3-nitrobenzyl)amine Formula: C17H14N6O2S MolecularWeight: 366.39706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=C(N=C2S1)N3C=CC=N3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(N=C(N=C2S1)N3C=CC=N3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O2S/c1-11-8-14-15(18-10-12-4-2-5-13(9-12)23(24)25)20-17(21-16(14)26-11)22-7-3-6-19-22/h2-9H,10H2,1H3,(H,18,20,21)