3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-methoxyphenyl)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-1H-pyrazole-5-carboxamide Formula: C18H22N4O2 MolecularWeight: 326.39288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O2/c1-12-4-3-5-14(10-12)19-22-18(23)17-11-16(20-21-17)13-6-8-15(24-2)9-7-13/h6-9,11-12H,3-5,10H2,1-2H3,(H,20,21)(H,22,23)/b19-14-/t12-/m0/s1