(2R)-2-(carbamothioylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-(carbamothioylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-(carbamothioylamino)-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-(carbamothioylamino)-3-(1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-(carbamothioylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-thioureido-propionate Formula: C12H12N3O2S- MolecularWeight: 262.30758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])NC(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)[O-])NC(=S)N

InChI

InChI=1S/C12H13N3O2S/c13-12(18)15-10(11(16)17)5-7-6-14-9-4-2-1-3-8(7)9/h1-4,6,10,14H,5H2,(H,16,17)(H3,13,15,18)/p-1/t10-/m1/s1