2-(1,3-benzoxazol-2-ylamino)-6-(1,3-benzoxazol-2-ylsulfanylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-6-(1,3-benzoxazol-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-6-(1,3-benzoxazol-2-ylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(1,3-benzoxazol-2-ylamino)-6-[(1,3-benzoxazol-2-ylthio)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-6-(1,3-benzoxazol-2-ylsulfanylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-6-[(1,3-benzoxazol-2-ylthio)methyl]-1H-pyrimidin-4-one Formula: C19H13N5O3S MolecularWeight: 391.40322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C19H13N5O3S/c25-16-9-11(10-28-19-22-13-6-2-4-8-15(13)27-19)20-17(23-16)24-18-21-12-5-1-3-7-14(12)26-18/h1-9H,10H2,(H2,20,21,23,24,25)