(E)-2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enethioamide

Systemtic Name: (E)-2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enethioamide Openeye Name: (E)-2-cyano-3-(2-isopropoxyphenyl)prop-2-enethioamide CAS Name: (E)-2-cyano-3-(2-propan-2-yloxyphenyl)-2-propenethioamide IUPAC Name: (E)-2-cyano-3-(2-propan-2-yloxyphenyl)prop-2-enethioamide Traditional Name: (E)-2-cyano-3-(2-isopropoxyphenyl)thioacrylamide Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C=C(C#N)C(=S)N

Isomeric SMILES

CC(C)OC1=CC=CC=C1/C=C(\C#N)/C(=S)N

InChI

InChI=1S/C13H14N2OS/c1-9(2)16-12-6-4-3-5-10(12)7-11(8-14)13(15)17/h3-7,9H,1-2H3,(H2,15,17)/b11-7+