(2R)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[3-[(4-fluorophenyl)thio]propanoylamino]-3-(1H-indol-3-yl)propionate Formula: C20H18FN2O3S- MolecularWeight: 385.431923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)[O-])NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O3S/c21-14-5-7-15(8-6-14)27-10-9-19(24)23-18(20(25)26)11-13-12-22-17-4-2-1-3-16(13)17/h1-8,12,18,22H,9-11H2,(H,23,24)(H,25,26)/p-1/t18-/m1/s1