2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-1-(1,3-benzodioxol-5-yl)ethanone

Systemtic Name: 2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-1-(1,3-benzodioxol-5-yl)ethanone Openeye Name: 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanyl-1-(1,3-benzodioxol-5-yl)ethanone CAS Name: 2-[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]-1-(1,3-benzodioxol-5-yl)ethanone IUPAC Name: 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanyl-1-(1,3-benzodioxol-5-yl)ethanone Traditional Name: 2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]-1-(1,3-benzodioxol-5-yl)ethanone Formula: C15H11N3O3S2 MolecularWeight: 345.39614

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C15H11N3O3S2/c16-13-9-3-4-22-14(9)18-15(17-13)23-6-10(19)8-1-2-11-12(5-8)21-7-20-11/h1-5H,6-7H2,(H2,16,17,18)