[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-acetamido-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-acetamido-4-thiophen-2-yl-3-thiophenecarboxylic acid [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl] 2-acetamido-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-acetamido-4-(2-thienyl)thiophene-3-carboxylic acid [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=C(SC=C2C3=CC=CS3)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)OC(=O)C2=C(SC=C2C3=CC=CS3)NC(=O)C

InChI

InChI=1S/C20H24N2O4S2/c1-13(19(24)22-9-5-3-4-6-10-22)26-20(25)17-15(16-8-7-11-27-16)12-28-18(17)21-14(2)23/h7-8,11-13H,3-6,9-10H2,1-2H3,(H,21,23)/t13-/m1/s1