N-[(E)-[azanyl-(6-phenylmethoxypyrazin-2-yl)methylidene]amino]piperidine-1-carbothioamide

Systemtic Name: N-[(E)-[azanyl-(6-phenylmethoxypyrazin-2-yl)methylidene]amino]piperidine-1-carbothioamide Openeye Name: N-[(E)-[amino-(6-benzyloxypyrazin-2-yl)methylene]amino]piperidine-1-carbothioamide CAS Name: N-[(E)-[amino-(6-phenylmethoxy-2-pyrazinyl)methylidene]amino]-1-piperidinecarbothioamide IUPAC Name: N-[(E)-[amino-(6-phenylmethoxypyrazin-2-yl)methylidene]amino]piperidine-1-carbothioamide Traditional Name: N-[(E)-[amino-(6-benzoxypyrazin-2-yl)methylene]amino]piperidine-1-carbothioamide Formula: C18H22N6OS MolecularWeight: 370.47188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)NN=C(C2=CN=CC(=N2)OCC3=CC=CC=C3)N

Isomeric SMILES

C1CCN(CC1)C(=S)N/N=C(\C2=CN=CC(=N2)OCC3=CC=CC=C3)/N

InChI

InChI=1S/C18H22N6OS/c19-17(22-23-18(26)24-9-5-2-6-10-24)15-11-20-12-16(21-15)25-13-14-7-3-1-4-8-14/h1,3-4,7-8,11-12H,2,5-6,9-10,13H2,(H2,19,22)(H,23,26)