2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethanethiol

Systemtic Name: 2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethanethiol Openeye Name: 2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethanethiol CAS Name: 2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethanethiol IUPAC Name: 2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethanethiol Traditional Name: 2-[6-(1,3-benzoxazol-2-ylamino)-2,4-dihydro-1H-s-triazin-3-yl]ethanethiol Formula: C12H15N5OS MolecularWeight: 277.3454

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=NCN1CCS)NC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1NC(=NCN1CCS)NC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C12H15N5OS/c19-6-5-17-7-13-11(14-8-17)16-12-15-9-3-1-2-4-10(9)18-12/h1-4,19H,5-8H2,(H2,13,14,15,16)