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

Systemtic Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-ethyl-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)-(3-nitrobenzyl)amine Formula: C18H16N6O2S MolecularWeight: 380.42364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)N3C=CC=N3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)N3C=CC=N3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O2S/c1-2-14-10-15-16(19-11-12-5-3-6-13(9-12)24(25)26)21-18(22-17(15)27-14)23-8-4-7-20-23/h3-10H,2,11H2,1H3,(H,19,21,22)