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

Systemtic Name: tert-butyl 2-(cyclohexylcarbamoylamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: tert-butyl 6-benzyl-2-(cyclohexylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[[(cyclohexylamino)-oxomethyl]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-(cyclohexylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-benzyl-2-(cyclohexylcarbamoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid tert-butyl ester Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=O)NC4CCCCC4

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=O)NC4CCCCC4

InChI

InChI=1S/C26H35N3O3S/c1-26(2,3)32-24(30)22-20-14-15-29(16-18-10-6-4-7-11-18)17-21(20)33-23(22)28-25(31)27-19-12-8-5-9-13-19/h4,6-7,10-11,19H,5,8-9,12-17H2,1-3H3,(H2,27,28,31)