4-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-7-methoxychromen-2-one Traditional Name: 4-[[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]methyl]-7-methoxy-coumarin Formula: C17H13N3O3S2 MolecularWeight: 371.43342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C17H13N3O3S2/c1-22-10-2-3-11-9(6-14(21)23-13(11)7-10)8-25-17-19-15(18)12-4-5-24-16(12)20-17/h2-7H,8H2,1H3,(H2,18,19,20)