N-[(E)-[azanyl-(6-methoxypyrazin-2-yl)methylidene]amino]-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-[(E)-[azanyl-(6-methoxypyrazin-2-yl)methylidene]amino]-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-[(E)-[amino-(6-methoxypyrazin-2-yl)methylene]amino]-4-phenyl-piperazine-1-carbothioamide CAS Name: N-[(E)-[amino-(6-methoxy-2-pyrazinyl)methylidene]amino]-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-[(E)-[amino-(6-methoxypyrazin-2-yl)methylidene]amino]-4-phenylpiperazine-1-carbothioamide Traditional Name: N-[(E)-[amino-(6-methoxypyrazin-2-yl)methylene]amino]-4-phenyl-piperazine-1-carbothioamide Formula: C17H21N7OS MolecularWeight: 371.45994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=NC(=CN=C1)/C(=N\NC(=S)N2CCN(CC2)C3=CC=CC=C3)/N

InChI

InChI=1S/C17H21N7OS/c1-25-15-12-19-11-14(20-15)16(18)21-22-17(26)24-9-7-23(8-10-24)13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H2,18,21)(H,22,26)