ethyl 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]hydrazo]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC3=C(S2)CCC(C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC3=C(S2)CC[C@H](C3)C(C)(C)C

InChI

InChI=1S/C22H33N3O4S/c1-5-29-21(28)25-10-8-14(9-11-25)19(26)23-24-20(27)18-13-15-12-16(22(2,3)4)6-7-17(15)30-18/h13-14,16H,5-12H2,1-4H3,(H,23,26)(H,24,27)/t16-/m1/s1