N-[3-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]propyl]adamantane-1-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H32N4O2/c1-28(16-21-15-27-29(17-21)22-5-3-2-4-6-22)23(30)7-8-26-24(31)25-12-18-9-19(13-25)11-20(10-18)14-25/h2-6,15,17-20H,7-14,16H2,1H3,(H,26,31)