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

Systemtic Name: N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]-3-methyl-butyramide Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3S/c1-4-5-6-7-12-25-16-10-8-15(9-11-16)18(24)21-22-19(26)20-17(23)13-14(2)3/h8-11,14H,4-7,12-13H2,1-3H3,(H,21,24)(H2,20,22,23,26)