ethyl 5-[2-azanyl-4-[(2-dimethylaminoethylamino)methyl]phenyl]carbonyl-3-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-[2-azanyl-4-[(2-dimethylaminoethylamino)methyl]phenyl]carbonyl-3-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-[2-amino-4-[(2-dimethylaminoethylamino)methyl]benzoyl]-3-[(4-methoxyphenyl)methyl]triazole-4-carboxylate CAS Name: 5-[[2-amino-4-[(2-dimethylaminoethylamino)methyl]phenyl]-oxomethyl]-3-[(4-methoxyphenyl)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-amino-4-[(2-dimethylaminoethylamino)methyl]benzoyl]-3-[(4-methoxyphenyl)methyl]triazole-4-carboxylate Traditional Name: 5-[2-amino-4-[(2-dimethylaminoethylamino)methyl]benzoyl]-3-p-anisyl-triazole-4-carboxylic acid ethyl ester Formula: C25H32N6O4 MolecularWeight: 480.55938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=NN1CC2=CC=C(C=C2)OC)C(=O)C3=C(C=C(C=C3)CNCCN(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(N=NN1CC2=CC=C(C=C2)OC)C(=O)C3=C(C=C(C=C3)CNCCN(C)C)N

InChI

InChI=1S/C25H32N6O4/c1-5-35-25(33)23-22(28-29-31(23)16-17-6-9-19(34-4)10-7-17)24(32)20-11-8-18(14-21(20)26)15-27-12-13-30(2)3/h6-11,14,27H,5,12-13,15-16,26H2,1-4H3