N-(3-carbamothioylphenyl)-3-(4-methylpentoxy)propanamide

Systemtic Name: N-(3-carbamothioylphenyl)-3-(4-methylpentoxy)propanamide Openeye Name: N-(3-carbamothioylphenyl)-3-isohexyloxy-propanamide CAS Name: N-(3-carbamothioylphenyl)-3-(4-methylpentoxy)propanamide IUPAC Name: N-(3-carbamothioylphenyl)-3-(4-methylpentoxy)propanamide Traditional Name: 3-isohexyloxy-N-(3-thiocarbamoylphenyl)propionamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOCCC(=O)NC1=CC=CC(=C1)C(=S)N

Isomeric SMILES

CC(C)CCCOCCC(=O)NC1=CC=CC(=C1)C(=S)N

InChI

InChI=1S/C16H24N2O2S/c1-12(2)5-4-9-20-10-8-15(19)18-14-7-3-6-13(11-14)16(17)21/h3,6-7,11-12H,4-5,8-10H2,1-2H3,(H2,17,21)(H,18,19)