N-[[4-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]hydrazo]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)carbamoyl]benzyl]adamantane-1-carboxamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H31N3O3S/c31-24(29-30-25(32)23-11-21-2-1-3-22(21)34-23)20-6-4-16(5-7-20)15-28-26(33)27-12-17-8-18(13-27)10-19(9-17)14-27/h4-7,11,17-19H,1-3,8-10,12-15H2,(H,28,33)(H,29,31)(H,30,32)