(2S)-N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[4-(1-adamantyl)thiazol-2-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-(1-adamantyl)-2-thiazolyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-(1-adamantyl)thiazol-2-yl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H27N3O2S2/c27-20(17-3-1-5-26(17)21(28)18-4-2-6-29-18)25-22-24-19(13-30-22)23-10-14-7-15(11-23)9-16(8-14)12-23/h2,4,6,13-17H,1,3,5,7-12H2,(H,24,25,27)/t14?,15?,16?,17-,23?/m0/s1