5-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 5-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pentan-1-one Openeye Name: 5-[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]sulfanyl-1-(4-cinnamylpiperazin-1-yl)pentan-1-one CAS Name: 5-[[4,5-bis(4-methoxyphenyl)-1-propyl-2-imidazolyl]thio]-1-[4-(3-phenylprop-2-enyl)-1-piperazinyl]-1-pentanone IUPAC Name: 5-[4,5-bis(4-methoxyphenyl)-1-propylimidazol-2-yl]sulfanyl-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pentan-1-one Traditional Name: 5-[[4,5-bis(4-methoxyphenyl)-1-propyl-imidazol-2-yl]thio]-1-(4-cinnamylpiperazino)pentan-1-one Formula: C38H46N4O3S MolecularWeight: 638.86184

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CCCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C38H46N4O3S/c1-4-23-42-37(32-17-21-34(45-3)22-18-32)36(31-15-19-33(44-2)20-16-31)39-38(42)46-29-9-8-14-35(43)41-27-25-40(26-28-41)24-10-13-30-11-6-5-7-12-30/h5-7,10-13,15-22H,4,8-9,14,23-29H2,1-3H3