1-[(E)-(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(4-oxidanylidenepyrido[1,2-a]pyrimidin-3-yl)methylideneamino]thiourea Openeye Name: [(E)-(4-oxopyrido[1,2-a]pyrimidin-3-yl)methyleneamino]thiourea CAS Name: [(E)-(4-oxo-3-pyrido[1,2-a]pyrimidinyl)methylideneamino]thiourea IUPAC Name: [(E)-(4-oxopyrido[1,2-a]pyrimidin-3-yl)methylideneamino]thiourea Traditional Name: [(E)-(4-ketopyrido[1,2-a]pyrimidin-3-yl)methyleneamino]thiourea Formula: C10H9N5OS MolecularWeight: 247.27636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=O)N2C=C1)C=NNC(=S)N

Isomeric SMILES

C1=CC2=NC=C(C(=O)N2C=C1)/C=N/NC(=S)N

InChI

InChI=1S/C10H9N5OS/c11-10(17)14-13-6-7-5-12-8-3-1-2-4-15(8)9(7)16/h1-6H,(H3,11,14,17)/b13-6+