4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-butanamide

Systemtic Name: 4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-butanamide Openeye Name: 4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-phenethyl-butanamide CAS Name: 4-[[1-ethyl-4,5-bis(4-methoxyphenyl)-2-imidazolyl]thio]-N-phenethylbutanamide IUPAC Name: 4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-phenethylbutanamide Traditional Name: 4-[[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]thio]-N-phenethyl-butyramide Formula: C31H35N3O3S MolecularWeight: 529.6929

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C(=C(N=C1SCCCC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H35N3O3S/c1-4-34-30(25-14-18-27(37-3)19-15-25)29(24-12-16-26(36-2)17-13-24)33-31(34)38-22-8-11-28(35)32-21-20-23-9-6-5-7-10-23/h5-7,9-10,12-19H,4,8,11,20-22H2,1-3H3,(H,32,35)