(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1H-indol-6-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1H-indol-6-ylamino)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-(1H-indol-6-ylamino)-4-oxo-butanoate CAS Name: 4-(1H-indol-6-ylamino)-4-oxobutanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-(1H-indol-6-ylamino)-4-oxobutanoate Traditional Name: 4-(1H-indol-6-ylamino)-4-keto-butyric acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C18H16N2O4S MolecularWeight: 356.39564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)CCC(=O)NC2=CC3=C(C=C2)C=CN3

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)CCC(=O)NC2=CC3=C(C=C2)C=CN3

InChI

InChI=1S/C18H16N2O4S/c21-15(16-2-1-9-25-16)11-24-18(23)6-5-17(22)20-13-4-3-12-7-8-19-14(12)10-13/h1-4,7-10,19H,5-6,11H2,(H,20,22)