N-[(4-phenylpiperazin-1-yl)methyl]-6-pyrrolidin-1-yl-pyrazine-2-carbothioamide

Systemtic Name: N-[(4-phenylpiperazin-1-yl)methyl]-6-pyrrolidin-1-yl-pyrazine-2-carbothioamide Openeye Name: N-[(4-phenylpiperazin-1-yl)methyl]-6-pyrrolidin-1-yl-pyrazine-2-carbothioamide CAS Name: N-[(4-phenyl-1-piperazinyl)methyl]-6-(1-pyrrolidinyl)-2-pyrazinecarbothioamide IUPAC Name: N-[(4-phenylpiperazin-1-yl)methyl]-6-pyrrolidin-1-ylpyrazine-2-carbothioamide Traditional Name: N-[(4-phenylpiperazino)methyl]-6-pyrrolidino-thiopyrazinamide Formula: C20H26N6S MolecularWeight: 382.52564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=CN=C2)C(=S)NCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=NC(=CN=C2)C(=S)NCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H26N6S/c27-20(18-14-21-15-19(23-18)26-8-4-5-9-26)22-16-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-3,6-7,14-15H,4-5,8-13,16H2,(H,22,27)