N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[4-(1-adamantyl)thiazol-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-(1-adamantyl)-2-thiazolyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[4-(1-adamantyl)thiazol-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-11-18(13(3)26)12(2)23-19(11)20(27)25-21-24-17(10-28-21)22-7-14-4-15(8-22)6-16(5-14)9-22/h10,14-16,23H,4-9H2,1-3H3,(H,24,25,27)