N-(3-methoxyphenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(3-methoxyphenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(3-methoxyphenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide CAS Name: N-(3-methoxyphenyl)-4-(2-pyrazinyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-methoxyphenyl)-4-pyrazin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(3-methoxyphenyl)-4-pyrazin-2-yl-piperazine-1-carbothioamide Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)C3=NC=CN=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)C3=NC=CN=C3

InChI

InChI=1S/C16H19N5OS/c1-22-14-4-2-3-13(11-14)19-16(23)21-9-7-20(8-10-21)15-12-17-5-6-18-15/h2-6,11-12H,7-10H2,1H3,(H,19,23)