N-[(4-heptoxyphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]octanamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]octanamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]octanamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]caprylamide Formula: C22H36N2O2S MolecularWeight: 392.59844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCCCCCCC

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCCCCCCC

InChI

InChI=1S/C22H36N2O2S/c1-3-5-7-9-11-13-21(25)24-22(27)23-19-14-16-20(17-15-19)26-18-12-10-8-6-4-2/h14-17H,3-13,18H2,1-2H3,(H2,23,24,25,27)