N-(6-azanylhexyl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-pentanamide

Systemtic Name: N-(6-azanylhexyl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-pentanamide Openeye Name: N-(6-aminohexyl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-pentanamide CAS Name: N-(6-aminohexyl)-5-[[1-ethyl-4,5-bis(4-methoxyphenyl)-2-imidazolyl]thio]pentanamide IUPAC Name: N-(6-aminohexyl)-5-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylpentanamide Traditional Name: N-(6-aminohexyl)-5-[[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]thio]valeramide Formula: C30H42N4O3S MolecularWeight: 538.74448

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCC(=O)NCCCCCCN)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=C(N=C1SCCCCC(=O)NCCCCCCN)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C30H42N4O3S/c1-4-34-29(24-14-18-26(37-3)19-15-24)28(23-12-16-25(36-2)17-13-23)33-30(34)38-22-10-7-11-27(35)32-21-9-6-5-8-20-31/h12-19H,4-11,20-22,31H2,1-3H3,(H,32,35)