N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-bromanyl-adamantane-1-carboxamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-bromanyl-adamantane-1-carboxamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-bromo-adamantane-1-carboxamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-3-bromo-1-adamantanecarboxamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-bromoadamantane-1-carboxamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-bromo-adamantane-1-carboxamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C22H24BrN3O2S/c1-13(27)24-17-4-2-16(3-5-17)18-11-29-20(25-18)26-19(28)21-7-14-6-15(8-21)10-22(23,9-14)12-21/h2-5,11,14-15H,6-10,12H2,1H3,(H,24,27)(H,25,26,28)