N-octadecyl-3-sulfanyl-benzamide

Systemtic Name: N-octadecyl-3-sulfanyl-benzamide Openeye Name: N-octadecyl-3-sulfanyl-benzamide CAS Name: 3-mercapto-N-octadecylbenzamide IUPAC Name: N-octadecyl-3-sulfanylbenzamide Traditional Name: 3-mercapto-N-stearyl-benzamide Formula: C25H43NOS MolecularWeight: 405.68002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=CC=C1)S

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=CC=C1)S

InChI

InChI=1S/C25H43NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-25(27)23-19-18-20-24(28)22-23/h18-20,22,28H,2-17,21H2,1H3,(H,26,27)