2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3,3-bis(methylsulfanyl)prop-2-enenitrile

Systemtic Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3,3-bis(methylsulfanyl)prop-2-enenitrile Openeye Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3,3-bis(methylsulfanyl)prop-2-enenitrile CAS Name: 2-[4-(4-bromophenyl)-2-thiazolyl]-3,3-bis(methylthio)-2-propenenitrile IUPAC Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3,3-bis(methylsulfanyl)prop-2-enenitrile Traditional Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3,3-bis(methylthio)acrylonitrile Formula: C14H11BrN2S3 MolecularWeight: 383.34954

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C1=NC(=CS1)C2=CC=C(C=C2)Br)SC

Isomeric SMILES

CSC(=C(C#N)C1=NC(=CS1)C2=CC=C(C=C2)Br)SC

InChI

InChI=1S/C14H11BrN2S3/c1-18-14(19-2)11(7-16)13-17-12(8-20-13)9-3-5-10(15)6-4-9/h3-6,8H,1-2H3