methyl 2-[2-(1-adamantylamino)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(1-adamantylamino)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1-adamantylamino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1-adamantylamino)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1-adamantylamino)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(1-adamantylamino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C20H28N2O3S MolecularWeight: 376.51292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C20H28N2O3S/c1-11-12(2)26-18(17(11)19(24)25-3)22-16(23)10-21-20-7-13-4-14(8-20)6-15(5-13)9-20/h13-15,21H,4-10H2,1-3H3,(H,22,23)