2-ethanoyl-5-phenyl-4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]-1,2,4-triazol-3-one

Systemtic Name: 2-ethanoyl-5-phenyl-4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]-1,2,4-triazol-3-one Openeye Name: 2-acetyl-5-phenyl-4-[(E)-(3,4,5-trimethoxyphenyl)methyleneamino]-1,2,4-triazol-3-one CAS Name: 2-acetyl-5-phenyl-4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]-1,2,4-triazol-3-one IUPAC Name: 2-acetyl-5-phenyl-4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]-1,2,4-triazol-3-one Traditional Name: 2-acetyl-5-phenyl-4-[(E)-(3,4,5-trimethoxybenzylidene)amino]-1,2,4-triazol-3-one Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=O)N(C(=N1)C2=CC=CC=C2)N=CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(=O)N1C(=O)N(C(=N1)C2=CC=CC=C2)/N=C/C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C20H20N4O5/c1-13(25)23-20(26)24(19(22-23)15-8-6-5-7-9-15)21-12-14-10-16(27-2)18(29-4)17(11-14)28-3/h5-12H,1-4H3/b21-12+