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

Systemtic Name: 3-bromanyl-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]adamantane-1-carboxamide Openeye Name: 3-bromo-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]adamantane-1-carboxamide CAS Name: 3-bromo-N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-1-adamantanecarboxamide IUPAC Name: 3-bromo-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]adamantane-1-carboxamide Traditional Name: 3-bromo-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]adamantane-1-carboxamide Formula: C23H27BrN2OS MolecularWeight: 459.44228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C23H27BrN2OS/c1-15-26-20(13-28-15)19-4-2-16(3-5-19)6-7-25-21(27)22-9-17-8-18(10-22)12-23(24,11-17)14-22/h2-5,13,17-18H,6-12,14H2,1H3,(H,25,27)