N-[(1S)-1-(1-adamantyl)propyl]-4-bromanyl-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)propyl]-4-bromanyl-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[(1S)-1-(1-adamantyl)propyl]-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[(1S)-1-(1-adamantyl)propyl]-4-bromo-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[(1S)-1-(1-adamantyl)propyl]-4-bromo-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[(1S)-1-(1-adamantyl)propyl]-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide Formula: C19H28BrN3O MolecularWeight: 394.34912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C(=NN4C)C)Br

Isomeric SMILES

CC[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C(=NN4C)C)Br

InChI

InChI=1S/C19H28BrN3O/c1-4-15(21-18(24)17-16(20)11(2)22-23(17)3)19-8-12-5-13(9-19)7-14(6-12)10-19/h12-15H,4-10H2,1-3H3,(H,21,24)/t12?,13?,14?,15-,19?/m0/s1