3-(1,3-benzodioxol-5-ylamino)-6-(phenylmethyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylamino)-6-(phenylmethyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(1,3-benzodioxol-5-ylamino)-6-benzyl-2H-1,2,4-triazin-5-one CAS Name: 3-(1,3-benzodioxol-5-ylamino)-6-(phenylmethyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(1,3-benzodioxol-5-ylamino)-6-benzyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(1,3-benzodioxol-5-ylamino)-6-benzyl-2H-1,2,4-triazin-5-one Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=O)C(=NN3)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=O)C(=NN3)CC4=CC=CC=C4

InChI

InChI=1S/C17H14N4O3/c22-16-13(8-11-4-2-1-3-5-11)20-21-17(19-16)18-12-6-7-14-15(9-12)24-10-23-14/h1-7,9H,8,10H2,(H2,18,19,21,22)