N-[[3-(diethylcarbamoyl)phenyl]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[3-(diethylcarbamoyl)phenyl]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[3-(diethylcarbamoyl)phenyl]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[3-[diethylamino(oxo)methyl]anilino]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[3-(diethylcarbamoyl)phenyl]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[3-(diethylcarbamoyl)phenyl]thiocarbamoyl]-2-hexoxy-benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)CC

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)CC

InChI

InChI=1S/C25H33N3O3S/c1-4-7-8-11-17-31-22-16-10-9-15-21(22)23(29)27-25(32)26-20-14-12-13-19(18-20)24(30)28(5-2)6-3/h9-10,12-16,18H,4-8,11,17H2,1-3H3,(H2,26,27,29,32)