2-(ethylsulfanylcarbamoylamino)-2-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-(ethylsulfanylcarbamoylamino)-2-(1H-indol-3-yl)propanoic acid Openeye Name: 2-(ethylsulfanylcarbamoylamino)-2-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[[(ethylthio)amino]-oxomethyl]amino]-2-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-(ethylsulfanylcarbamoylamino)-2-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(ethylthio)carbamoylamino]-2-(1H-indol-3-yl)propionic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCSNC(=O)NC(C)(C1=CNC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCSNC(=O)NC(C)(C1=CNC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17N3O3S/c1-3-21-17-13(20)16-14(2,12(18)19)10-8-15-11-7-5-4-6-9(10)11/h4-8,15H,3H2,1-2H3,(H,18,19)(H2,16,17,20)