2-[4-(4-oxidanylbutyl)phenyl]benzenecarbothioamide

Systemtic Name: 2-[4-(4-oxidanylbutyl)phenyl]benzenecarbothioamide Openeye Name: 2-[4-(4-hydroxybutyl)phenyl]benzenecarbothioamide CAS Name: 2-[4-(4-hydroxybutyl)phenyl]benzenecarbothioamide IUPAC Name: 2-[4-(4-hydroxybutyl)phenyl]benzenecarbothioamide Traditional Name: 2-[4-(4-hydroxybutyl)phenyl]thiobenzamide Formula: C17H19NOS MolecularWeight: 285.40386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCCO)C(=S)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCCO)C(=S)N

InChI

InChI=1S/C17H19NOS/c18-17(20)16-7-2-1-6-15(16)14-10-8-13(9-11-14)5-3-4-12-19/h1-2,6-11,19H,3-5,12H2,(H2,18,20)