4-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]oxyphenyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]oxyphenyl]piperazine-1-carbaldehyde Openeye Name: 4-[4-[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propoxy]phenyl]piperazine-1-carbaldehyde CAS Name: 4-[4-[1-(1-imidazolyl)-4-(5-methyl-2-thiophenyl)butan-2-yl]oxyphenyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-[1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl]oxyphenyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propoxy]phenyl]piperazine-1-carbaldehyde Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CCC(CN2C=CN=C2)OC3=CC=C(C=C3)N4CCN(CC4)C=O

Isomeric SMILES

CC1=CC=C(S1)CCC(CN2C=CN=C2)OC3=CC=C(C=C3)N4CCN(CC4)C=O

InChI

InChI=1S/C23H28N4O2S/c1-19-2-8-23(30-19)9-7-22(16-26-11-10-24-17-26)29-21-5-3-20(4-6-21)27-14-12-25(18-28)13-15-27/h2-6,8,10-11,17-18,22H,7,9,12-16H2,1H3