N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]-3,3-dimethyl-butanamide Openeye Name: N-[3-[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]sulfanylpropyl]-3,3-dimethyl-butanamide CAS Name: N-[3-[[1-ethyl-4,5-bis(4-methylphenyl)-2-imidazolyl]thio]propyl]-3,3-dimethylbutanamide IUPAC Name: N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]-3,3-dimethylbutanamide Traditional Name: N-[3-[[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]thio]propyl]-3,3-dimethyl-butyramide Formula: C28H37N3OS MolecularWeight: 463.67788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCNC(=O)CC(C)(C)C)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=C(N=C1SCCCNC(=O)CC(C)(C)C)C2=CC=C(C=C2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H37N3OS/c1-7-31-26(23-15-11-21(3)12-16-23)25(22-13-9-20(2)10-14-22)30-27(31)33-18-8-17-29-24(32)19-28(4,5)6/h9-16H,7-8,17-19H2,1-6H3,(H,29,32)