N-[2-[4-(6-chloranyl-2-pentan-3-ylsulfanyl-1H-benzimidazol-5-yl)piperazin-1-yl]ethyl]ethanamide

Systemtic Name: N-[2-[4-(6-chloranyl-2-pentan-3-ylsulfanyl-1H-benzimidazol-5-yl)piperazin-1-yl]ethyl]ethanamide Openeye Name: N-[2-[4-[6-chloro-2-(1-ethylpropylsulfanyl)-1H-benzimidazol-5-yl]piperazin-1-yl]ethyl]acetamide CAS Name: N-[2-[4-[6-chloro-2-(pentan-3-ylthio)-1H-benzimidazol-5-yl]-1-piperazinyl]ethyl]acetamide IUPAC Name: N-[2-[4-(6-chloro-2-pentan-3-ylsulfanyl-1H-benzimidazol-5-yl)piperazin-1-yl]ethyl]acetamide Traditional Name: N-[2-[4-[6-chloro-2-(1-ethylpropylthio)-1H-benzimidazol-5-yl]piperazino]ethyl]acetamide Formula: C20H30ClN5OS MolecularWeight: 424.0031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CCNC(=O)C

Isomeric SMILES

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCN(CC3)CCNC(=O)C

InChI

InChI=1S/C20H30ClN5OS/c1-4-15(5-2)28-20-23-17-12-16(21)19(13-18(17)24-20)26-10-8-25(9-11-26)7-6-22-14(3)27/h12-13,15H,4-11H2,1-3H3,(H,22,27)(H,23,24)