methyl 6-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)carbamothioylamino]hexanoate Openeye Name: methyl 6-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamothioylamino]hexanoate CAS Name: 6-[[[[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamothioylamino]hexanoate Traditional Name: 6-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)thiocarbamoylamino]hexanoic acid methyl ester Formula: C16H23N3O3S2 MolecularWeight: 369.50212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=S)NNC(=O)C1=CC2=C(S1)CCC2

Isomeric SMILES

COC(=O)CCCCCNC(=S)NNC(=O)C1=CC2=C(S1)CCC2

InChI

InChI=1S/C16H23N3O3S2/c1-22-14(20)8-3-2-4-9-17-16(23)19-18-15(21)13-10-11-6-5-7-12(11)24-13/h10H,2-9H2,1H3,(H,18,21)(H2,17,19,23)