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

Systemtic Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyridin-4-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-ethyl-2-(4-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-(3-nitrobenzyl)amine Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C3=CC=NC=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C3=CC=NC=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O2S/c1-2-16-11-17-19(22-12-13-4-3-5-15(10-13)25(26)27)23-18(24-20(17)28-16)14-6-8-21-9-7-14/h3-11H,2,12H2,1H3,(H,22,23,24)