5-azanyl-N-(4-phenoxyphenyl)-3-phenylazanyl-1,2,4-triazole-1-carboxamide

Systemtic Name: 5-azanyl-N-(4-phenoxyphenyl)-3-phenylazanyl-1,2,4-triazole-1-carboxamide Openeye Name: 5-amino-3-anilino-N-(4-phenoxyphenyl)-1,2,4-triazole-1-carboxamide CAS Name: 5-amino-3-anilino-N-(4-phenoxyphenyl)-1,2,4-triazole-1-carboxamide IUPAC Name: 5-amino-3-anilino-N-(4-phenoxyphenyl)-1,2,4-triazole-1-carboxamide Traditional Name: 5-amino-3-anilino-N-(4-phenoxyphenyl)-1,2,4-triazole-1-carboxamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN(C(=N2)N)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN(C(=N2)N)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H18N6O2/c22-19-25-20(23-15-7-3-1-4-8-15)26-27(19)21(28)24-16-11-13-18(14-12-16)29-17-9-5-2-6-10-17/h1-14H,(H,24,28)(H3,22,23,25,26)