2-[(3-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-[(3-nitrophenyl)methylthio]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-[(3-nitrobenzyl)thio]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C13H10N4O2S2 MolecularWeight: 318.3741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NC(=C3C=CSC3=N2)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NC(=C3C=CSC3=N2)N

InChI

InChI=1S/C13H10N4O2S2/c14-11-10-4-5-20-12(10)16-13(15-11)21-7-8-2-1-3-9(6-8)17(18)19/h1-6H,7H2,(H2,14,15,16)