methyl 6-[[(E)-(1-ethyl-5-methyl-2-oxidanylidene-indol-3-ylidene)amino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(E)-(1-ethyl-5-methyl-2-oxidanylidene-indol-3-ylidene)amino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(E)-(1-ethyl-5-methyl-2-oxo-indolin-3-ylidene)amino]carbamothioylamino]hexanoate CAS Name: 6-[[[(2E)-2-(1-ethyl-5-methyl-2-oxo-3-indolylidene)hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(E)-(1-ethyl-5-methyl-2-oxoindol-3-ylidene)amino]carbamothioylamino]hexanoate Traditional Name: 6-[[(E)-(1-ethyl-2-keto-5-methyl-indolin-3-ylidene)amino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C)C(=NNC(=S)NCCCCCC(=O)OC)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C)/C(=N\NC(=S)NCCCCCC(=O)OC)/C1=O

InChI

InChI=1S/C19H26N4O3S/c1-4-23-15-10-9-13(2)12-14(15)17(18(23)25)21-22-19(27)20-11-7-5-6-8-16(24)26-3/h9-10,12H,4-8,11H2,1-3H3,(H2,20,22,27)/b21-17+