methyl N-[[4-butoxy-2-(4-oxidanylidenebutanoylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[4-butoxy-2-(4-oxidanylidenebutanoylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[4-butoxy-2-(4-oxobutanoylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[4-butoxy-2-(1,4-dioxobutylamino)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[4-butoxy-2-(4-oxobutanoylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[4-butoxy-2-(4-ketobutanoylamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=O)CCC=O

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=O)CCC=O

InChI

InChI=1S/C17H23N3O5S/c1-3-4-10-25-12-7-8-13(19-16(26)20-17(23)24-2)14(11-12)18-15(22)6-5-9-21/h7-9,11H,3-6,10H2,1-2H3,(H,18,22)(H2,19,20,23,26)