methyl 6-[[(3,4-dichlorophenyl)amino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(3,4-dichlorophenyl)amino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[(3,4-dichloroanilino)carbamothioylamino]hexanoate CAS Name: 6-[[[(3,4-dichlorophenyl)hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(3,4-dichloroanilino)carbamothioylamino]hexanoate Traditional Name: 6-[(3,4-dichloroanilino)thiocarbamoylamino]hexanoic acid methyl ester Formula: C14H19Cl2N3O2S MolecularWeight: 364.29056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=S)NNC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)CCCCCNC(=S)NNC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H19Cl2N3O2S/c1-21-13(20)5-3-2-4-8-17-14(22)19-18-10-6-7-11(15)12(16)9-10/h6-7,9,18H,2-5,8H2,1H3,(H2,17,19,22)