(5-azanyl-3-phenylazanyl-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone

Systemtic Name: (5-azanyl-3-phenylazanyl-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone Openeye Name: (5-amino-3-anilino-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone CAS Name: (5-amino-3-anilino-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone IUPAC Name: (5-amino-3-anilino-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone Traditional Name: (5-amino-3-anilino-1,2,4-triazol-1-yl)-(1,3-benzodioxol-5-yl)methanone Formula: C16H13N5O3 MolecularWeight: 323.30612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)N3C(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)N3C(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C16H13N5O3/c17-15-19-16(18-11-4-2-1-3-5-11)20-21(15)14(22)10-6-7-12-13(8-10)24-9-23-12/h1-8H,9H2,(H3,17,18,19,20)