5-azanylidene-2-(phenylmethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-2-(phenylmethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 2-benzyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-2-(phenylmethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 2-benzyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 2-benzyl-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C12H10N4OS MolecularWeight: 258.299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=N)N2C(=NC1=O)SC(=N2)CC3=CC=CC=C3

Isomeric SMILES

C1C(=N)N2C(=NC1=O)SC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C12H10N4OS/c13-9-7-10(17)14-12-16(9)15-11(18-12)6-8-4-2-1-3-5-8/h1-5,13H,6-7H2