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

Systemtic Name: 6-chloranyl-N-[(3-nitrophenyl)methyl]-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-chloro-N-[(3-nitrophenyl)methyl]-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-chloro-N-[(3-nitrophenyl)methyl]-2-(2-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-chloro-N-[(3-nitrophenyl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-chloro-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-(3-nitrobenzyl)amine Formula: C18H12ClN5O2S MolecularWeight: 397.83818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=C3C=C(SC3=N2)Cl)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)C2=NC(=C3C=C(SC3=N2)Cl)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12ClN5O2S/c19-15-9-13-16(21-10-11-4-3-5-12(8-11)24(25)26)22-17(23-18(13)27-15)14-6-1-2-7-20-14/h1-9H,10H2,(H,21,22,23)