methyl 2-(pyridin-4-ylmethylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-(pyridin-4-ylmethylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-(4-pyridylmethylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(pyridin-4-ylmethylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-(4-pyridylmethylcarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=O)NCC3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C16H17N3O3S/c1-22-15(20)13-11-3-2-4-12(11)23-14(13)19-16(21)18-9-10-5-7-17-8-6-10/h5-8H,2-4,9H2,1H3,(H2,18,19,21)