1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-4-[3-(cyclopentoxy)-4-methoxy-benzyl]-1,4-diazepane Formula: C24H35ClN4O2 MolecularWeight: 447.0133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCCN(CC2)CC3=CC(=C(C=C3)OC)OC4CCCC4)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CN2CCCN(CC2)CC3=CC(=C(C=C3)OC)OC4CCCC4)Cl)C

InChI

InChI=1S/C24H35ClN4O2/c1-18-21(24(25)27(2)26-18)17-29-12-6-11-28(13-14-29)16-19-9-10-22(30-3)23(15-19)31-20-7-4-5-8-20/h9-10,15,20H,4-8,11-14,16-17H2,1-3H3