2-(1-adamantylcarbonylamino)-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-(1-adamantylcarbonylamino)-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-(adamantane-1-carbonylamino)-N-cyclopropyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-(adamantane-1-carbonylamino)-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-(adamantane-1-carbonylamino)-N-cyclopropyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)NC6CC6

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)NC6CC6

InChI

InChI=1S/C23H30N2O2S/c26-20(24-16-5-6-16)19-17-3-1-2-4-18(17)28-21(19)25-22(27)23-10-13-7-14(11-23)9-15(8-13)12-23/h13-16H,1-12H2,(H,24,26)(H,25,27)