methyl (1R,2R,3R,8aS)-3-aminocarbonyl-1-cyano-6-ethanoyl-2-thiophen-2-yl-3,8a-dihydro-2H-indolizine-1-carboxylate

Systemtic Name: methyl (1R,2R,3R,8aS)-3-aminocarbonyl-1-cyano-6-ethanoyl-2-thiophen-2-yl-3,8a-dihydro-2H-indolizine-1-carboxylate Openeye Name: methyl (1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-thienyl)-3,8a-dihydro-2H-indolizine-1-carboxylate CAS Name: (1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-thiophen-2-yl-3,8a-dihydro-2H-indolizine-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-thiophen-2-yl-3,8a-dihydro-2H-indolizine-1-carboxylate Traditional Name: (1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-thienyl)-3,8a-dihydro-2H-indolizine-1-carboxylic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN2C(C=C1)C(C(C2C(=O)N)C3=CC=CS3)(C#N)C(=O)OC

Isomeric SMILES

CC(=O)C1=CN2[C@@H](C=C1)[C@]([C@H]([C@@H]2C(=O)N)C3=CC=CS3)(C#N)C(=O)OC

InChI

InChI=1S/C18H17N3O4S/c1-10(22)11-5-6-13-18(9-19,17(24)25-2)14(12-4-3-7-26-12)15(16(20)23)21(13)8-11/h3-8,13-15H,1-2H3,(H2,20,23)/t13-,14-,15+,18-/m0/s1