N-(4-phenoxyphenyl)pyrrolidine-1-carbothioamide

Systemtic Name: N-(4-phenoxyphenyl)pyrrolidine-1-carbothioamide Openeye Name: N-(4-phenoxyphenyl)pyrrolidine-1-carbothioamide CAS Name: N-(4-phenoxyphenyl)-1-pyrrolidinecarbothioamide IUPAC Name: N-(4-phenoxyphenyl)pyrrolidine-1-carbothioamide Traditional Name: N-(4-phenoxyphenyl)pyrrolidine-1-carbothioamide Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C17H18N2OS/c21-17(19-12-4-5-13-19)18-14-8-10-16(11-9-14)20-15-6-2-1-3-7-15/h1-3,6-11H,4-5,12-13H2,(H,18,21)