N-(4-bromanyl-3-methyl-phenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(2-pyrazinyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-pyrazin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Formula: C16H18BrN5S MolecularWeight: 392.31662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C3=NC=CN=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C3=NC=CN=C3)Br

InChI

InChI=1S/C16H18BrN5S/c1-12-10-13(2-3-14(12)17)20-16(23)22-8-6-21(7-9-22)15-11-18-4-5-19-15/h2-5,10-11H,6-9H2,1H3,(H,20,23)