O-methyl 3-(phenylsulfonyl)-2-(prop-2-enoylamino)pentanethioate

Systemtic Name: O-methyl 3-(phenylsulfonyl)-2-(prop-2-enoylamino)pentanethioate Openeye Name: O-methyl 3-(benzenesulfonyl)-2-(prop-2-enoylamino)pentanethioate CAS Name: 3-(benzenesulfonyl)-2-(1-oxoprop-2-enylamino)pentanethioic acid O-methyl ester IUPAC Name: O-methyl 3-(benzenesulfonyl)-2-(prop-2-enoylamino)pentanethioate Traditional Name: 2-acrylamido-3-besyl-pentanethioic acid O-methyl ester Formula: C15H19NO4S2 MolecularWeight: 341.44566

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=S)OC)NC(=O)C=C)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(C(C(=S)OC)NC(=O)C=C)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H19NO4S2/c1-4-12(14(15(21)20-3)16-13(17)5-2)22(18,19)11-9-7-6-8-10-11/h5-10,12,14H,2,4H2,1,3H3,(H,16,17)