tert-butyl 2-(diethylcarbamoylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: tert-butyl 2-(diethylcarbamoylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: tert-butyl 6-benzyl-2-(diethylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[diethylamino(oxo)methyl]amino]-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-benzyl-2-(diethylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-benzyl-2-(diethylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC1=C(C2=C(S1)CN(CC2)CC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCN(CC)C(=O)NC1=C(C2=C(S1)CN(CC2)CC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H33N3O3S/c1-6-27(7-2)23(29)25-21-20(22(28)30-24(3,4)5)18-13-14-26(16-19(18)31-21)15-17-11-9-8-10-12-17/h8-12H,6-7,13-16H2,1-5H3,(H,25,29)