3-[4-(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylpiperazin-1-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[4-(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylpiperazin-1-yl]pyrazine-2-carbonitrile Openeye Name: 3-[4-[(4-bromo-5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]pyrazine-2-carbonitrile CAS Name: 3-[4-[(4-bromo-5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-pyrazinecarbonitrile IUPAC Name: 3-[4-(4-bromo-5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]pyrazine-2-carbonitrile Traditional Name: 3-[4-[(4-bromo-5-chloro-2-thienyl)sulfonyl]piperazino]pyrazinonitrile Formula: C13H11BrClN5O2S2 MolecularWeight: 448.74574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2C#N)S(=O)(=O)C3=CC(=C(S3)Cl)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2C#N)S(=O)(=O)C3=CC(=C(S3)Cl)Br

InChI

InChI=1S/C13H11BrClN5O2S2/c14-9-7-11(23-12(9)15)24(21,22)20-5-3-19(4-6-20)13-10(8-16)17-1-2-18-13/h1-2,7H,3-6H2