3-azanyl-2-heptyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-heptyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-heptyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-heptyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-amino-2-heptyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-heptyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C17H25N3OS MolecularWeight: 319.4649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N

Isomeric SMILES

CCCCCCCC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N

InChI

InChI=1S/C17H25N3OS/c1-2-3-4-5-6-11-14-19-16-15(17(21)20(14)18)12-9-7-8-10-13(12)22-16/h2-11,18H2,1H3