2-[[butyl-(phenylmethyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 2-[[butyl-(phenylmethyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 2-[[benzyl(butyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 2-[[butyl-(phenylmethyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 2-[[benzyl(butyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 2-[[benzyl(butyl)amino]methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)CC2=CC(=C3C=NC=CN3)C=CC2=O

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)CC2=CC(=C3C=NC=CN3)C=CC2=O

InChI

InChI=1S/C22H25N3O/c1-2-3-13-25(16-18-7-5-4-6-8-18)17-20-14-19(9-10-22(20)26)21-15-23-11-12-24-21/h4-12,14-15,24H,2-3,13,16-17H2,1H3