4-(cyclohexylamino)-3-(4-pentoxyphenyl)-1H-pyridazin-6-one

Systemtic Name: 4-(cyclohexylamino)-3-(4-pentoxyphenyl)-1H-pyridazin-6-one Openeye Name: 4-(cyclohexylamino)-3-(4-pentoxyphenyl)-1H-pyridazin-6-one CAS Name: 4-(cyclohexylamino)-3-(4-pentoxyphenyl)-1H-pyridazin-6-one IUPAC Name: 4-(cyclohexylamino)-3-(4-pentoxyphenyl)-1H-pyridazin-6-one Traditional Name: 3-(4-amoxyphenyl)-4-(cyclohexylamino)-1H-pyridazin-6-one Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NNC(=O)C=C2NC3CCCCC3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NNC(=O)C=C2NC3CCCCC3

InChI

InChI=1S/C21H29N3O2/c1-2-3-7-14-26-18-12-10-16(11-13-18)21-19(15-20(25)23-24-21)22-17-8-5-4-6-9-17/h10-13,15,17H,2-9,14H2,1H3,(H2,22,23,25)