methyl 4-[[(4-methoxy-3,3-dimethyl-4-oxidanylidene-butyl)carbamothioylamino]methylcarbamothioylamino]-2,2-dimethyl-butanoate

Systemtic Name: methyl 4-[[(4-methoxy-3,3-dimethyl-4-oxidanylidene-butyl)carbamothioylamino]methylcarbamothioylamino]-2,2-dimethyl-butanoate Openeye Name: methyl 4-[[(4-methoxy-3,3-dimethyl-4-oxo-butyl)carbamothioylamino]methylcarbamothioylamino]-2,2-dimethyl-butanoate CAS Name: 4-[[[[[[(4-methoxy-3,3-dimethyl-4-oxobutyl)amino]-sulfanylidenemethyl]amino]methylamino]-sulfanylidenemethyl]amino]-2,2-dimethylbutanoic acid methyl ester IUPAC Name: methyl 4-[[(4-methoxy-3,3-dimethyl-4-oxobutyl)carbamothioylamino]methylcarbamothioylamino]-2,2-dimethylbutanoate Traditional Name: 4-[[(4-keto-4-methoxy-3,3-dimethyl-butyl)thiocarbamoylamino]methylthiocarbamoylamino]-2,2-dimethyl-butyric acid methyl ester Formula: C17H32N4O4S2 MolecularWeight: 420.59038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCNC(=S)NCNC(=S)NCCC(C)(C)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(CCNC(=S)NCNC(=S)NCCC(C)(C)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H32N4O4S2/c1-16(2,12(22)24-5)7-9-18-14(26)20-11-21-15(27)19-10-8-17(3,4)13(23)25-6/h7-11H2,1-6H3,(H2,18,20,26)(H2,19,21,27)