6-azanyl-2-(benzotriazol-1-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(benzotriazol-1-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(benzotriazol-1-ylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-amino-2-(1-benzotriazolylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(benzotriazol-1-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(benzotriazol-1-ylmethylthio)-1H-pyrimidin-4-one Formula: C11H10N6OS MolecularWeight: 274.3017

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C11H10N6OS/c12-9-5-10(18)14-11(13-9)19-6-17-8-4-2-1-3-7(8)15-16-17/h1-5H,6H2,(H3,12,13,14,18)