5,6-dimethyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-N-[(E)-(5-nitro-2-furyl)methyleneamino]thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-[(E)-(5-nitro-2-furanyl)methylideneamino]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]thieno[2,3-d]pyrimidin-4-amine Traditional Name: (5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-[(E)-(5-nitro-2-furyl)methyleneamino]amine Formula: C13H11N5O3S MolecularWeight: 317.32314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NN=CC3=CC=C(O3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N/N=C/C3=CC=C(O3)[N+](=O)[O-])C

InChI

InChI=1S/C13H11N5O3S/c1-7-8(2)22-13-11(7)12(14-6-15-13)17-16-5-9-3-4-10(21-9)18(19)20/h3-6H,1-2H3,(H,14,15,17)/b16-5+