methyl 6-[[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(Z)-1-(4-morpholinophenyl)ethylideneamino]carbamothioylamino]hexanoate CAS Name: 6-[[[(2Z)-2-[1-[4-(4-morpholinyl)phenyl]ethylidene]hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]carbamothioylamino]hexanoate Traditional Name: 6-[[(Z)-1-(4-morpholinophenyl)ethylideneamino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C20H30N4O3S MolecularWeight: 406.5422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCCCCC(=O)OC)C1=CC=C(C=C1)N2CCOCC2

Isomeric SMILES

C/C(=N/NC(=S)NCCCCCC(=O)OC)/C1=CC=C(C=C1)N2CCOCC2

InChI

InChI=1S/C20H30N4O3S/c1-16(17-7-9-18(10-8-17)24-12-14-27-15-13-24)22-23-20(28)21-11-5-3-4-6-19(25)26-2/h7-10H,3-6,11-15H2,1-2H3,(H2,21,23,28)/b22-16-