2-[4-[(2-azanyl-5-thiophen-2-yl-phenyl)carbamoyl]phenyl]-2-pyrrolidin-1-yl-ethanoic acid

Systemtic Name: 2-[4-[(2-azanyl-5-thiophen-2-yl-phenyl)carbamoyl]phenyl]-2-pyrrolidin-1-yl-ethanoic acid Openeye Name: 2-[4-[[2-amino-5-(2-thienyl)phenyl]carbamoyl]phenyl]-2-pyrrolidin-1-yl-acetic acid CAS Name: 2-[4-[(2-amino-5-thiophen-2-ylanilino)-oxomethyl]phenyl]-2-(1-pyrrolidinyl)acetic acid IUPAC Name: 2-[4-[(2-amino-5-thiophen-2-ylphenyl)carbamoyl]phenyl]-2-pyrrolidin-1-ylacetic acid Traditional Name: 2-[4-[[2-amino-5-(2-thienyl)phenyl]carbamoyl]phenyl]-2-pyrrolidino-acetic acid Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)C(=O)O

Isomeric SMILES

C1CCN(C1)C(C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)C(=O)O

InChI

InChI=1S/C23H23N3O3S/c24-18-10-9-17(20-4-3-13-30-20)14-19(18)25-22(27)16-7-5-15(6-8-16)21(23(28)29)26-11-1-2-12-26/h3-10,13-14,21H,1-2,11-12,24H2,(H,25,27)(H,28,29)