methyl 6-[[(Z)-2,3-dihydrochromen-4-ylideneamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(Z)-2,3-dihydrochromen-4-ylideneamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(Z)-chroman-4-ylideneamino]carbamothioylamino]hexanoate CAS Name: 6-[[[(2Z)-2-(3,4-dihydro-2H-1-benzopyran-4-ylidene)hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(Z)-2,3-dihydrochromen-4-ylideneamino]carbamothioylamino]hexanoate Traditional Name: 6-[[(Z)-chroman-4-ylideneamino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=S)NN=C1CCOC2=CC=CC=C12

Isomeric SMILES

COC(=O)CCCCCNC(=S)N/N=C\1/CCOC2=CC=CC=C12

InChI

InChI=1S/C17H23N3O3S/c1-22-16(21)9-3-2-6-11-18-17(24)20-19-14-10-12-23-15-8-5-4-7-13(14)15/h4-5,7-8H,2-3,6,9-12H2,1H3,(H2,18,20,24)/b19-14-