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

Systemtic Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-ethyl-N-[(3-nitrophenyl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-ethyl-2-(3-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=CN=CC=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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