N-[(4-hexoxyphenyl)carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[(4-hexoxyanilino)-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(4-hexoxyphenyl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(4-hexoxyphenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CC(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C18H28N2O2S/c1-4-5-6-7-12-22-16-10-8-15(9-11-16)19-18(23)20-17(21)13-14(2)3/h8-11,14H,4-7,12-13H2,1-3H3,(H2,19,20,21,23)