methyl 3-[2-[2-[2-(propan-2-ylamino)ethanoylamino]phenyl]sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[2-[2-(propan-2-ylamino)ethanoylamino]phenyl]sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[2-[[2-(isopropylamino)acetyl]amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-[[2-[[1-oxo-2-(propan-2-ylamino)ethyl]amino]phenyl]thio]ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[2-[[2-(propan-2-ylamino)acetyl]amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[[2-[[2-(isopropylamino)acetyl]amino]phenyl]thio]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H23N3O4S2 MolecularWeight: 421.53362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(=O)NC1=CC=CC=C1SCC(=O)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CC(C)NCC(=O)NC1=CC=CC=C1SCC(=O)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C19H23N3O4S2/c1-12(2)20-10-16(23)21-13-6-4-5-7-15(13)28-11-17(24)22-14-8-9-27-18(14)19(25)26-3/h4-9,12,20H,10-11H2,1-3H3,(H,21,23)(H,22,24)