N-[(2-propan-2-yloxyphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(2-propan-2-yloxyphenyl)carbamothioyl]octanamide Openeye Name: N-[(2-isopropoxyphenyl)carbamothioyl]octanamide CAS Name: N-[(2-propan-2-yloxyanilino)-sulfanylidenemethyl]octanamide IUPAC Name: N-[(2-propan-2-yloxyphenyl)carbamothioyl]octanamide Traditional Name: N-[(2-isopropoxyphenyl)thiocarbamoyl]caprylamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OC(C)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1OC(C)C

InChI

InChI=1S/C18H28N2O2S/c1-4-5-6-7-8-13-17(21)20-18(23)19-15-11-9-10-12-16(15)22-14(2)3/h9-12,14H,4-8,13H2,1-3H3,(H2,19,20,21,23)