ethyl 2-[3-(benzotriazol-1-yl)propanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[3-(benzotriazol-1-yl)propanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(benzotriazol-1-yl)propanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[3-(1-benzotriazolyl)-1-oxopropyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(benzotriazol-1-yl)propanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(benzotriazol-1-yl)propanoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C3=CC=CC=C3N=N2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C3=CC=CC=C3N=N2)C

InChI

InChI=1S/C16H17N5O3S/c1-3-24-15(23)14-10(2)17-16(25-14)18-13(22)8-9-21-12-7-5-4-6-11(12)19-20-21/h4-7H,3,8-9H2,1-2H3,(H,17,18,22)