2-(phenylcarbamothioylamino)-3-pyrrolidin-1-yl-propanoic acid

Systemtic Name: 2-(phenylcarbamothioylamino)-3-pyrrolidin-1-yl-propanoic acid Openeye Name: 2-(phenylcarbamothioylamino)-3-pyrrolidin-1-yl-propanoic acid CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-3-(1-pyrrolidinyl)propanoic acid IUPAC Name: 2-(phenylcarbamothioylamino)-3-pyrrolidin-1-ylpropanoic acid Traditional Name: 2-(phenylthiocarbamoylamino)-3-pyrrolidino-propionic acid Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C(=O)O)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1CCN(C1)CC(C(=O)O)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C14H19N3O2S/c18-13(19)12(10-17-8-4-5-9-17)16-14(20)15-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,19)(H2,15,16,20)