N-(3-phenylsulfanylpropyl)pyrazine-2-carboxamide

Systemtic Name: N-(3-phenylsulfanylpropyl)pyrazine-2-carboxamide Openeye Name: N-(3-phenylsulfanylpropyl)pyrazine-2-carboxamide CAS Name: N-[3-(phenylthio)propyl]-2-pyrazinecarboxamide IUPAC Name: N-(3-phenylsulfanylpropyl)pyrazine-2-carboxamide Traditional Name: N-[3-(phenylthio)propyl]pyrazinamide Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=NC=CN=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=NC=CN=C2

InChI

InChI=1S/C14H15N3OS/c18-14(13-11-15-8-9-16-13)17-7-4-10-19-12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2,(H,17,18)