[1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate

Systemtic Name: [1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamidopropanoate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H19N3O5S MolecularWeight: 389.42556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC1=C(C=CS1)C(=O)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OC(C)C(=O)NC1=C(C=CS1)C(=O)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19N3O5S/c1-10(20-16(24)12-6-4-3-5-7-12)18(25)26-11(2)15(23)21-17-13(14(19)22)8-9-27-17/h3-11H,1-2H3,(H2,19,22)(H,20,24)(H,21,23)/t10-,11?/m0/s1