2-[5-aminocarbonyl-9-(pyridin-2-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-(pyridin-2-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid Openeye Name: 2-[5-carbamoyl-9-(2-pyridylmethyl)carbazol-4-yl]oxy-2-(2-thienyl)acetic acid CAS Name: 2-[[5-carbamoyl-9-(2-pyridinylmethyl)-4-carbazolyl]oxy]-2-thiophen-2-ylacetic acid IUPAC Name: 2-[5-carbamoyl-9-(pyridin-2-ylmethyl)carbazol-4-yl]oxy-2-thiophen-2-ylacetic acid Traditional Name: 2-[5-carbamoyl-9-(2-pyridylmethyl)carbazol-4-yl]oxy-2-(2-thienyl)acetic acid Formula: C25H19N3O4S MolecularWeight: 457.50106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN2C3=C(C(=CC=C3)OC(C4=CC=CS4)C(=O)O)C5=C(C=CC=C52)C(=O)N

Isomeric SMILES

C1=CC=NC(=C1)CN2C3=C(C(=CC=C3)OC(C4=CC=CS4)C(=O)O)C5=C(C=CC=C52)C(=O)N

InChI

InChI=1S/C25H19N3O4S/c26-24(29)16-7-3-8-17-21(16)22-18(28(17)14-15-6-1-2-12-27-15)9-4-10-19(22)32-23(25(30)31)20-11-5-13-33-20/h1-13,23H,14H2,(H2,26,29)(H,30,31)