N-[(2-methoxyphenyl)methyl]-1H-cinnoline-2-carbothioamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-1H-cinnoline-2-carbothioamide Openeye Name: N-[(2-methoxyphenyl)methyl]-1H-cinnoline-2-carbothioamide CAS Name: N-[(2-methoxyphenyl)methyl]-1H-cinnoline-2-carbothioamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-1H-cinnoline-2-carbothioamide Traditional Name: N-o-anisyl-1H-cinnoline-2-carbothioamide Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=S)N2C=CC3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=CC=C1CNC(=S)N2C=CC3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3OS/c1-21-16-9-5-3-7-14(16)12-18-17(22)20-11-10-13-6-2-4-8-15(13)19-20/h2-11,19H,12H2,1H3,(H,18,22)