2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]-oxidanyl-methyl]prop-2-enenitrile

Systemtic Name: 2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]-oxidanyl-methyl]prop-2-enenitrile Openeye Name: 2-[[2-(3-bromophenyl)thiazol-4-yl]-hydroxy-methyl]prop-2-enenitrile CAS Name: 2-[[2-(3-bromophenyl)-4-thiazolyl]-hydroxymethyl]-2-propenenitrile IUPAC Name: 2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]-hydroxymethyl]prop-2-enenitrile Traditional Name: 2-[[2-(3-bromophenyl)thiazol-4-yl]-hydroxy-methyl]acrylonitrile Formula: C13H9BrN2OS MolecularWeight: 321.19236

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C#N)C(C1=CSC(=N1)C2=CC(=CC=C2)Br)O

Isomeric SMILES

C=C(C#N)C(C1=CSC(=N1)C2=CC(=CC=C2)Br)O

InChI

InChI=1S/C13H9BrN2OS/c1-8(6-15)12(17)11-7-18-13(16-11)9-3-2-4-10(14)5-9/h2-5,7,12,17H,1H2