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

Systemtic Name: methyl 4-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)carbamothioylamino]butanoate Openeye Name: methyl 4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamothioylamino]butanoate CAS Name: 4-[[[[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]hydrazo]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamothioylamino]butanoate Traditional Name: 4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)thiocarbamoylamino]butyric acid methyl ester Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3S2/c1-20-12(18)6-3-7-15-14(21)17-16-13(19)11-8-9-4-2-5-10(9)22-11/h8H,2-7H2,1H3,(H,16,19)(H2,15,17,21)