octyl 4-(dimethylcarbamothioylamino)benzoate

Systemtic Name: octyl 4-(dimethylcarbamothioylamino)benzoate Openeye Name: octyl 4-(dimethylcarbamothioylamino)benzoate CAS Name: 4-[[dimethylamino(sulfanylidene)methyl]amino]benzoic acid octyl ester IUPAC Name: octyl 4-(dimethylcarbamothioylamino)benzoate Traditional Name: 4-(dimethylthiocarbamoylamino)benzoic acid octyl ester Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=S)N(C)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=S)N(C)C

InChI

InChI=1S/C18H28N2O2S/c1-4-5-6-7-8-9-14-22-17(21)15-10-12-16(13-11-15)19-18(23)20(2)3/h10-13H,4-9,14H2,1-3H3,(H,19,23)