2-(4-octylphenyl)benzenecarbothioamide

Systemtic Name: 2-(4-octylphenyl)benzenecarbothioamide Openeye Name: 2-(4-octylphenyl)benzenecarbothioamide CAS Name: 2-(4-octylphenyl)benzenecarbothioamide IUPAC Name: 2-(4-octylphenyl)benzenecarbothioamide Traditional Name: 2-(4-octylphenyl)thiobenzamide Formula: C21H27NS MolecularWeight: 325.51078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C(=S)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C(=S)N

InChI

InChI=1S/C21H27NS/c1-2-3-4-5-6-7-10-17-13-15-18(16-14-17)19-11-8-9-12-20(19)21(22)23/h8-9,11-16H,2-7,10H2,1H3,(H2,22,23)