(2S)-2-azanyl-1-[3,4-bis(oxidanyl)phenyl]-3-sulfanyl-propan-1-one

Systemtic Name: (2S)-2-azanyl-1-[3,4-bis(oxidanyl)phenyl]-3-sulfanyl-propan-1-one Openeye Name: (2S)-2-amino-1-(3,4-dihydroxyphenyl)-3-sulfanyl-propan-1-one CAS Name: (2S)-2-amino-1-(3,4-dihydroxyphenyl)-3-mercapto-1-propanone IUPAC Name: (2S)-2-amino-1-(3,4-dihydroxyphenyl)-3-sulfanylpropan-1-one Traditional Name: (2S)-2-amino-1-(3,4-dihydroxyphenyl)-3-mercapto-propan-1-one Formula: C9H11NO3S MolecularWeight: 213.25354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)C(CS)N)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[C@@H](CS)N)O)O

InChI

InChI=1S/C9H11NO3S/c10-6(4-14)9(13)5-1-2-7(11)8(12)3-5/h1-3,6,11-12,14H,4,10H2/t6-/m1/s1