5-(1-adamantyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1-adamantyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-(1-adamantyl)-N-[(E)-(4-isopropylphenyl)methyleneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-(1-adamantyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1-adamantyl)-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-(1-adamantyl)-N-[(E)-(4-isopropylbenzylidene)amino]-1H-pyrazole-3-carboxamide Formula: C24H30N4O MolecularWeight: 390.5212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=NNC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H30N4O/c1-15(2)20-5-3-16(4-6-20)14-25-28-23(29)21-10-22(27-26-21)24-11-17-7-18(12-24)9-19(8-17)13-24/h3-6,10,14-15,17-19H,7-9,11-13H2,1-2H3,(H,26,27)(H,28,29)/b25-14+