propyl 4-[[4-(3-methylbutoxy)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[4-(3-methylbutoxy)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[(4-isopentyloxyphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[4-(3-methylbutoxy)phenyl]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(4-isoamoxyphenyl)thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C19H28N2O4S MolecularWeight: 380.50162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)OCCC(C)C

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)OCCC(C)C

InChI

InChI=1S/C19H28N2O4S/c1-4-12-25-18(23)10-9-17(22)21-19(26)20-15-5-7-16(8-6-15)24-13-11-14(2)3/h5-8,14H,4,9-13H2,1-3H3,(H2,20,21,22,26)