4-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-4-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-butan-1-one CAS Name: 4-[[4,5-bis(4-methoxyphenyl)-1-propyl-2-imidazolyl]thio]-1-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-4-[4,5-bis(4-methoxyphenyl)-1-propylimidazol-2-yl]sulfanylbutan-1-one Traditional Name: 1-(4-benzylpiperazino)-4-[[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]thio]butan-1-one Formula: C35H42N4O3S MolecularWeight: 598.79798

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CCCN1C(=C(N=C1SCCCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C35H42N4O3S/c1-4-20-39-34(29-14-18-31(42-3)19-15-29)33(28-12-16-30(41-2)17-13-28)36-35(39)43-25-8-11-32(40)38-23-21-37(22-24-38)26-27-9-6-5-7-10-27/h5-7,9-10,12-19H,4,8,11,20-26H2,1-3H3