6-nitro-2-(1,2-oxazol-5-yl)-N-phenethyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-nitro-2-(1,2-oxazol-5-yl)-N-phenethyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-isoxazol-5-yl-6-nitro-N-phenethyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(5-isoxazolyl)-6-nitro-N-phenethyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-nitro-2-(1,2-oxazol-5-yl)-N-phenethylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-isoxazol-5-yl-6-nitro-thieno[2,3-d]pyrimidin-4-yl)-phenethyl-amine Formula: C17H13N5O3S MolecularWeight: 367.38182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C3C=C(SC3=NC(=N2)C4=CC=NO4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C3C=C(SC3=NC(=N2)C4=CC=NO4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O3S/c23-22(24)14-10-12-15(18-8-6-11-4-2-1-3-5-11)20-16(21-17(12)26-14)13-7-9-19-25-13/h1-5,7,9-10H,6,8H2,(H,18,20,21)