S-[(E)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-enyl] benzenecarbothioate

Systemtic Name: S-[(E)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-enyl] benzenecarbothioate Openeye Name: S-[(E)-3-(2-hydroxyethylamino)-3-oxo-prop-1-enyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[(E)-3-(2-hydroxyethylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(2-hydroxyethylamino)-3-oxoprop-1-enyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[(E)-3-(2-hydroxyethylamino)-3-keto-prop-1-enyl] ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC=CC(=O)NCCO

Isomeric SMILES

C1=CC=C(C=C1)C(=O)S/C=C/C(=O)NCCO

InChI

InChI=1S/C12H13NO3S/c14-8-7-13-11(15)6-9-17-12(16)10-4-2-1-3-5-10/h1-6,9,14H,7-8H2,(H,13,15)/b9-6+