3-(8-phenyloctyl)benzenecarbothioamide

Systemtic Name: 3-(8-phenyloctyl)benzenecarbothioamide Openeye Name: 3-(8-phenyloctyl)benzenecarbothioamide CAS Name: 3-(8-phenyloctyl)benzenecarbothioamide IUPAC Name: 3-(8-phenyloctyl)benzenecarbothioamide Traditional Name: 3-(8-phenyloctyl)thiobenzamide Formula: C21H27NS MolecularWeight: 325.51078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C21H27NS/c22-21(23)20-16-10-15-19(17-20)14-7-4-2-1-3-6-11-18-12-8-5-9-13-18/h5,8-10,12-13,15-17H,1-4,6-7,11,14H2,(H2,22,23)