methyl 4-[[4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butyl]carbamothioylamino]benzoate

Systemtic Name: methyl 4-[[4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butyl]carbamothioylamino]benzoate Openeye Name: methyl 4-[(4-tert-butoxy-4-oxo-butyl)carbamothioylamino]benzoate CAS Name: 4-[[[[4-[(2-methylpropan-2-yl)oxy]-4-oxobutyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(2-methylpropan-2-yl)oxy]-4-oxobutyl]carbamothioylamino]benzoate Traditional Name: 4-[(4-tert-butoxy-4-keto-butyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C17H24N2O4S/c1-17(2,3)23-14(20)6-5-11-18-16(24)19-13-9-7-12(8-10-13)15(21)22-4/h7-10H,5-6,11H2,1-4H3,(H2,18,19,24)