N-butyl-2-methyl-N-(phenethylcarbamothioyl)propanamide

Systemtic Name: N-butyl-2-methyl-N-(phenethylcarbamothioyl)propanamide Openeye Name: N-butyl-2-methyl-N-(phenethylcarbamothioyl)propanamide CAS Name: N-butyl-2-methyl-N-[(phenethylamino)-sulfanylidenemethyl]propanamide IUPAC Name: N-butyl-2-methyl-N-(phenethylcarbamothioyl)propanamide Traditional Name: N-butyl-2-methyl-N-(phenethylthiocarbamoyl)propionamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)C(C)C)C(=S)NCCC1=CC=CC=C1

Isomeric SMILES

CCCCN(C(=O)C(C)C)C(=S)NCCC1=CC=CC=C1

InChI

InChI=1S/C17H26N2OS/c1-4-5-13-19(16(20)14(2)3)17(21)18-12-11-15-9-7-6-8-10-15/h6-10,14H,4-5,11-13H2,1-3H3,(H,18,21)