2-[3-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[3-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[3-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[3-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]propyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C13H14N5OS3- MolecularWeight: 352.47816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CCCSC3=N[N-]C(=N)S3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CCCSC3=N[N-]C(=N)S3)C

InChI

InChI=1S/C13H15N5OS3/c1-6-7(2)21-11-9(6)10(19)15-8(16-11)4-3-5-20-13-18-17-12(14)22-13/h3-5H2,1-2H3,(H3,14,15,16,17,19)/p-1