methyl 6-[[(Z)-1-(2,4,5-trimethylphenyl)ethylideneamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(Z)-1-(2,4,5-trimethylphenyl)ethylideneamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(Z)-1-(2,4,5-trimethylphenyl)ethylideneamino]carbamothioylamino]hexanoate CAS Name: 6-[[sulfanylidene-[(2Z)-2-[1-(2,4,5-trimethylphenyl)ethylidene]hydrazinyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(Z)-1-(2,4,5-trimethylphenyl)ethylideneamino]carbamothioylamino]hexanoate Traditional Name: 6-[[(Z)-1-(2,4,5-trimethylphenyl)ethylideneamino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=NNC(=S)NCCCCCC(=O)OC)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1/C(=N\NC(=S)NCCCCCC(=O)OC)/C)C)C

InChI

InChI=1S/C19H29N3O2S/c1-13-11-15(3)17(12-14(13)2)16(4)21-22-19(25)20-10-8-6-7-9-18(23)24-5/h11-12H,6-10H2,1-5H3,(H2,20,22,25)/b21-16-