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

Systemtic Name: 5-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-methyl-N-[(3-nitrophenyl)methyl]-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-methyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-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=CSC2=NC(=NC(=C12)NCC3=CC(=CC=C3)[N+](=O)[O-])N4C=CC=N4

Isomeric SMILES

CC1=CSC2=NC(=NC(=C12)NCC3=CC(=CC=C3)[N+](=O)[O-])N4C=CC=N4

InChI

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