S-(2-acetamidoethyl) (E)-3-[4-(3-methylbut-2-enoxy)phenyl]prop-2-enethioate

Systemtic Name: S-(2-acetamidoethyl) (E)-3-[4-(3-methylbut-2-enoxy)phenyl]prop-2-enethioate Openeye Name: S-(2-acetamidoethyl) (E)-3-[4-(3-methylbut-2-enoxy)phenyl]prop-2-enethioate CAS Name: (E)-3-[4-(3-methylbut-2-enoxy)phenyl]-2-propenethioic acid S-(2-acetamidoethyl) ester IUPAC Name: S-(2-acetamidoethyl) (E)-3-[4-(3-methylbut-2-enoxy)phenyl]prop-2-enethioate Traditional Name: (E)-3-[4-(3-methylbut-2-enoxy)phenyl]prop-2-enethioic acid S-(2-acetamidoethyl) ester Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC=C(C=C1)C=CC(=O)SCCNC(=O)C)C

Isomeric SMILES

CC(=CCOC1=CC=C(C=C1)/C=C/C(=O)SCCNC(=O)C)C

InChI

InChI=1S/C18H23NO3S/c1-14(2)10-12-22-17-7-4-16(5-8-17)6-9-18(21)23-13-11-19-15(3)20/h4-10H,11-13H2,1-3H3,(H,19,20)/b9-6+