butyl 3-(pentanoylcarbamothioylamino)benzoate

Systemtic Name: butyl 3-(pentanoylcarbamothioylamino)benzoate Openeye Name: butyl 3-(pentanoylcarbamothioylamino)benzoate CAS Name: 3-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-(pentanoylcarbamothioylamino)benzoate Traditional Name: 3-(valerylthiocarbamoylamino)benzoic acid butyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)OCCCC

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)OCCCC

InChI

InChI=1S/C17H24N2O3S/c1-3-5-10-15(20)19-17(23)18-14-9-7-8-13(12-14)16(21)22-11-6-4-2/h7-9,12H,3-6,10-11H2,1-2H3,(H2,18,19,20,23)