N-tert-butyl-2-[2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[2-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]acetamide CAS Name: N-tert-butyl-2-[2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-1-benzimidazolyl]acetamide IUPAC Name: N-tert-butyl-2-[2-[2-(cyclohexylamino)-2-oxoethyl]sulfanylbenzimidazol-1-yl]acetamide Traditional Name: N-tert-butyl-2-[2-[[2-(cyclohexylamino)-2-keto-ethyl]thio]benzimidazol-1-yl]acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)NC3CCCCC3

Isomeric SMILES

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)NC3CCCCC3

InChI

InChI=1S/C21H30N4O2S/c1-21(2,3)24-18(26)13-25-17-12-8-7-11-16(17)23-20(25)28-14-19(27)22-15-9-5-4-6-10-15/h7-8,11-12,15H,4-6,9-10,13-14H2,1-3H3,(H,22,27)(H,24,26)