N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]octanamide

Systemtic Name: N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]octanamide Openeye Name: N-[(4-isopropoxyphenyl)methylcarbamothioyl]octanamide CAS Name: N-[[(4-propan-2-yloxyphenyl)methylamino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]octanamide Traditional Name: N-[(4-isopropoxybenzyl)thiocarbamoyl]caprylamide Formula: C19H30N2O2S MolecularWeight: 350.5187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NCC1=CC=C(C=C1)OC(C)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NCC1=CC=C(C=C1)OC(C)C

InChI

InChI=1S/C19H30N2O2S/c1-4-5-6-7-8-9-18(22)21-19(24)20-14-16-10-12-17(13-11-16)23-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H2,20,21,22,24)