N-[1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylamino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylamino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C(C(C)C)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C(C(C)C)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H40N4O2/c1-18(2)26(31-28(35)29-13-22-10-23(14-29)12-24(11-22)15-29)27(34)30-16-25-19(3)32-33(20(25)4)17-21-8-6-5-7-9-21/h5-9,18,22-24,26H,10-17H2,1-4H3,(H,30,34)(H,31,35)