5-azanyl-1-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-N-phenethyl-triazole-4-carboxamide CAS Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-phenethyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-phenethyltriazole-4-carboxamide Traditional Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-keto-ethyl]-N-phenethyl-triazole-4-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

InChI

InChI=1S/C21H24N6O2/c1-14-7-6-8-15(2)18(14)24-17(28)13-27-20(22)19(25-26-27)21(29)23-12-11-16-9-4-3-5-10-16/h3-10H,11-13,22H2,1-2H3,(H,23,29)(H,24,28)