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methyl 2-[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]ethanoylamino]hexanoate

methyl 2-[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]ethanoylamino]hexanoate

Systemtic Name:methyl 2-[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]ethanoylamino]hexanoate
Openeye Name:methyl 2-[[2-[(4-methoxy-2-methyl-phenyl)carbamothioylamino]acetyl]amino]hexanoate
CAS Name:2-[[2-[[(4-methoxy-2-methylanilino)-sulfanylidenemethyl]amino]-1-oxoethyl]amino]hexanoic acid methyl ester
IUPAC Name:methyl 2-[[2-[(4-methoxy-2-methylphenyl)carbamothioylamino]acetyl]amino]hexanoate
Traditional Name:2-[[2-[(4-methoxy-2-methyl-phenyl)thiocarbamoylamino]acetyl]amino]hexanoic acid methyl ester
Formula: C18H27N3O4S
MolecularWeight: 381.48968
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)CNC(=S)NC1=C(C=C(C=C1)OC)C


Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)CNC(=S)NC1=C(C=C(C=C1)OC)C


InChI

InChI=1S/C18H27N3O4S/c1-5-6-7-15(17(23)25-4)20-16(22)11-19-18(26)21-14-9-8-13(24-3)10-12(14)2/h8-10,15H,5-7,11H2,1-4H3,(H,20,22)(H2,19,21,26)


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