propyl N-[[4-butylsulfinyl-2-(propoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: propyl N-[[4-butylsulfinyl-2-(propoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Openeye Name: propyl N-[[4-butylsulfinyl-2-(propoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[4-butylsulfinyl-2-[[[[oxo(propoxy)methyl]amino]-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]carbamic acid propyl ester IUPAC Name: propyl N-[[4-butylsulfinyl-2-(propoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[4-butylsulfinyl-2-(propoxycarbonylthiocarbamoylamino)phenyl]thiocarbamoyl]carbamic acid propyl ester Formula: C20H30N4O5S3 MolecularWeight: 502.671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=CC(=C(C=C1)NC(=S)NC(=O)OCCC)NC(=S)NC(=O)OCCC

Isomeric SMILES

CCCCS(=O)C1=CC(=C(C=C1)NC(=S)NC(=O)OCCC)NC(=S)NC(=O)OCCC

InChI

InChI=1S/C20H30N4O5S3/c1-4-7-12-32(27)14-8-9-15(21-17(30)23-19(25)28-10-5-2)16(13-14)22-18(31)24-20(26)29-11-6-3/h8-9,13H,4-7,10-12H2,1-3H3,(H2,21,23,25,30)(H2,22,24,26,31)