6-azanyl-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-amino-2-(1,3-benzothiazol-2-ylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(1,3-benzothiazol-2-ylmethylthio)-1H-pyrimidin-4-one Formula: C12H10N4OS2 MolecularWeight: 290.364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C12H10N4OS2/c13-9-5-10(17)16-12(15-9)18-6-11-14-7-3-1-2-4-8(7)19-11/h1-5H,6H2,(H3,13,15,16,17)