tert-butyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]hydrazo]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC3=C(S2)CCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NNC(=O)C2=CC3=C(S2)CCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-21(2,3)28-20(27)24-11-9-14(10-12-24)18(25)22-23-19(26)17-13-15-7-5-4-6-8-16(15)29-17/h13-14H,4-12H2,1-3H3,(H,22,25)(H,23,26)