methyl N-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[(3-isopentyloxybenzoyl)carbamothioylamino]carbamate CAS Name: N-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]carbamate Traditional Name: N-[(3-isoamoxybenzoyl)thiocarbamoylamino]carbamic acid methyl ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)OC

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)OC

InChI

InChI=1S/C15H21N3O4S/c1-10(2)7-8-22-12-6-4-5-11(9-12)13(19)16-14(23)17-18-15(20)21-3/h4-6,9-10H,7-8H2,1-3H3,(H,18,20)(H2,16,17,19,23)