1-[(1-ethenyl-5-methyl-pyrazol-4-yl)methyl]-4-(3-methoxyphenyl)-1,4-diazepane

Systemtic Name: 1-[(1-ethenyl-5-methyl-pyrazol-4-yl)methyl]-4-(3-methoxyphenyl)-1,4-diazepane Openeye Name: 1-(3-methoxyphenyl)-4-[(5-methyl-1-vinyl-pyrazol-4-yl)methyl]-1,4-diazepane CAS Name: 1-[(1-ethenyl-5-methyl-4-pyrazolyl)methyl]-4-(3-methoxyphenyl)-1,4-diazepane IUPAC Name: 1-[(1-ethenyl-5-methylpyrazol-4-yl)methyl]-4-(3-methoxyphenyl)-1,4-diazepane Traditional Name: 1-(3-methoxyphenyl)-4-[(5-methyl-1-vinyl-pyrazol-4-yl)methyl]-1,4-diazepane Formula: C19H26N4O MolecularWeight: 326.43594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C=C)CN2CCCN(CC2)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C=NN1C=C)CN2CCCN(CC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H26N4O/c1-4-23-16(2)17(14-20-23)15-21-9-6-10-22(12-11-21)18-7-5-8-19(13-18)24-3/h4-5,7-8,13-14H,1,6,9-12,15H2,2-3H3