methyl 1-[2-oxidanylidene-2-(1H-1,2,4-triazol-5-ylamino)ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-(1H-1,2,4-triazol-5-ylamino)ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-(1H-1,2,4-triazol-5-ylamino)ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-(1H-1,2,4-triazol-5-ylamino)ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(1H-1,2,4-triazol-5-ylamino)ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-(1H-1,2,4-triazol-5-ylamino)ethyl]indole-3-carboxylic acid methyl ester Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=NC=NN3

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=NC=NN3

InChI

InChI=1S/C14H13N5O3/c1-22-13(21)10-6-19(11-5-3-2-4-9(10)11)7-12(20)17-14-15-8-16-18-14/h2-6,8H,7H2,1H3,(H2,15,16,17,18,20)