ethyl 2-[2-(benzotriazol-1-yl)ethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(benzotriazol-1-yl)ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(benzotriazol-1-yl)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(benzotriazol-1-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H18N4O3S MolecularWeight: 358.41482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3N=N2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3N=N2)C(=O)OCC

InChI

InChI=1S/C17H18N4O3S/c1-3-11-9-12(17(23)24-4-2)16(25-11)18-15(22)10-21-14-8-6-5-7-13(14)19-20-21/h5-9H,3-4,10H2,1-2H3,(H,18,22)