(E)-3-methoxy-3-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]prop-2-enenitrile

Systemtic Name: (E)-3-methoxy-3-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]prop-2-enenitrile Openeye Name: (E)-3-methoxy-3-[2-(thiazol-2-ylmethylsulfanyl)ethylamino]prop-2-enenitrile CAS Name: (E)-3-methoxy-3-[2-(2-thiazolylmethylthio)ethylamino]-2-propenenitrile IUPAC Name: (E)-3-methoxy-3-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]prop-2-enenitrile Traditional Name: (E)-3-methoxy-3-[2-(thiazol-2-ylmethylthio)ethylamino]acrylonitrile Formula: C10H13N3OS2 MolecularWeight: 255.35972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=CC#N)NCCSCC1=NC=CS1

Isomeric SMILES

CO/C(=C/C#N)/NCCSCC1=NC=CS1

InChI

InChI=1S/C10H13N3OS2/c1-14-9(2-3-11)12-4-6-15-8-10-13-5-7-16-10/h2,5,7,12H,4,6,8H2,1H3/b9-2+