N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-[(3S)-3-methylcyclohexylidene]amino]-3-phenyl-1H-pyrazole-5-carboxamide Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=NNC(=O)C2=CC(=NN2)C3=CC=CC=C3)C1

Isomeric SMILES

C[C@H]1CCC/C(=N\NC(=O)C2=CC(=NN2)C3=CC=CC=C3)/C1

InChI

InChI=1S/C17H20N4O/c1-12-6-5-9-14(10-12)18-21-17(22)16-11-15(19-20-16)13-7-3-2-4-8-13/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,19,20)(H,21,22)/b18-14+/t12-/m0/s1