N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-[(1R)-1-(1-adamantyl)propyl]-3-(4-bromo-3-methyl-pyrazol-1-yl)propionamide Formula: C20H30BrN3O MolecularWeight: 408.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCN4C=C(C(=N4)C)Br

Isomeric SMILES

CC[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CCN4C=C(C(=N4)C)Br

InChI

InChI=1S/C20H30BrN3O/c1-3-18(20-9-14-6-15(10-20)8-16(7-14)11-20)22-19(25)4-5-24-12-17(21)13(2)23-24/h12,14-16,18H,3-11H2,1-2H3,(H,22,25)/t14?,15?,16?,18-,20?/m1/s1