2-[[5-[(3-carboxy-4-thiophen-2-yl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-thiophen-2-yl-thiophene-3-carboxylic acid

Systemtic Name: 2-[[5-[(3-carboxy-4-thiophen-2-yl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-thiophen-2-yl-thiophene-3-carboxylic acid Openeye Name: 2-[[5-[[3-carboxy-4-(2-thienyl)-2-thienyl]amino]-3,3-dimethyl-5-oxo-pentanoyl]amino]-4-(2-thienyl)thiophene-3-carboxylic acid CAS Name: 2-[[5-[(3-carboxy-4-thiophen-2-yl-2-thiophenyl)amino]-3,3-dimethyl-1,5-dioxopentyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid IUPAC Name: 2-[[5-[(3-carboxy-4-thiophen-2-ylthiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylic acid Traditional Name: 2-[[5-[[3-carboxy-4-(2-thienyl)-2-thienyl]amino]-5-keto-3,3-dimethyl-pentanoyl]amino]-4-(2-thienyl)-3-thenoic acid Formula: C25H22N2O6S4 MolecularWeight: 574.71198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)O)CC(=O)NC3=C(C(=CS3)C4=CC=CS4)C(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)O)CC(=O)NC3=C(C(=CS3)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C25H22N2O6S4/c1-25(2,9-17(28)26-21-19(23(30)31)13(11-36-21)15-5-3-7-34-15)10-18(29)27-22-20(24(32)33)14(12-37-22)16-6-4-8-35-16/h3-8,11-12H,9-10H2,1-2H3,(H,26,28)(H,27,29)(H,30,31)(H,32,33)