N-[1-[2-(1H-benzimidazol-2-yl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[1-[2-(1H-benzimidazol-2-yl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-tert-butyl-benzamide Openeye Name: N-[1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-3-methylsulfanyl-propyl]-4-tert-butyl-benzamide CAS Name: N-[1-[2-(1H-benzimidazol-2-yl)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]-4-tert-butylbenzamide IUPAC Name: N-[1-[2-(1H-benzimidazol-2-yl)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-4-tert-butylbenzamide Traditional Name: N-[1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-3-(methylthio)propyl]-4-tert-butyl-benzamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NCCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NCCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C25H32N4O2S/c1-25(2,3)18-11-9-17(10-12-18)23(30)29-21(14-16-32-4)24(31)26-15-13-22-27-19-7-5-6-8-20(19)28-22/h5-12,21H,13-16H2,1-4H3,(H,26,31)(H,27,28)(H,29,30)