N-[4-(4-bromophenyl)sulfanylphenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-5-methyl-pyrazinamide Formula: C18H14BrN3OS MolecularWeight: 400.29226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3OS/c1-12-10-21-17(11-20-12)18(23)22-14-4-8-16(9-5-14)24-15-6-2-13(19)3-7-15/h2-11H,1H3,(H,22,23)