4-[2-(3-azanylpyrrolidin-1-yl)-1,3-thiazol-4-yl]benzoic acid

Systemtic Name: 4-[2-(3-azanylpyrrolidin-1-yl)-1,3-thiazol-4-yl]benzoic acid Openeye Name: 4-[2-(3-aminopyrrolidin-1-yl)thiazol-4-yl]benzoic acid CAS Name: 4-[2-(3-amino-1-pyrrolidinyl)-4-thiazolyl]benzoic acid IUPAC Name: 4-[2-(3-aminopyrrolidin-1-yl)-1,3-thiazol-4-yl]benzoic acid Traditional Name: 4-[2-(3-aminopyrrolidino)thiazol-4-yl]benzoic acid Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CC1N)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C14H15N3O2S/c15-11-5-6-17(7-11)14-16-12(8-20-14)9-1-3-10(4-2-9)13(18)19/h1-4,8,11H,5-7,15H2,(H,18,19)