tert-butyl 5-decyl-2-(phenylmethoxycarbonylamino)thiophene-3-carboxylate

Systemtic Name: tert-butyl 5-decyl-2-(phenylmethoxycarbonylamino)thiophene-3-carboxylate Openeye Name: tert-butyl 2-(benzyloxycarbonylamino)-5-decyl-thiophene-3-carboxylate CAS Name: 5-decyl-2-(phenylmethoxycarbonylamino)-3-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-decyl-2-(phenylmethoxycarbonylamino)thiophene-3-carboxylate Traditional Name: 2-(benzyloxycarbonylamino)-5-decyl-thiophene-3-carboxylic acid tert-butyl ester Formula: C27H39NO4S MolecularWeight: 473.66786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(S1)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(S1)NC(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H39NO4S/c1-5-6-7-8-9-10-11-15-18-22-19-23(25(29)32-27(2,3)4)24(33-22)28-26(30)31-20-21-16-13-12-14-17-21/h12-14,16-17,19H,5-11,15,18,20H2,1-4H3,(H,28,30)