6-chloranyl-2-pentan-3-ylsulfanyl-5-piperazin-1-yl-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-pentan-3-ylsulfanyl-5-piperazin-1-yl-1H-benzimidazole Openeye Name: 6-chloro-2-(1-ethylpropylsulfanyl)-5-piperazin-1-yl-1H-benzimidazole CAS Name: 6-chloro-2-(pentan-3-ylthio)-5-(1-piperazinyl)-1H-benzimidazole IUPAC Name: 6-chloro-2-pentan-3-ylsulfanyl-5-piperazin-1-yl-1H-benzimidazole Traditional Name: 6-chloro-2-(1-ethylpropylthio)-5-piperazino-1H-benzimidazole Formula: C16H23ClN4S MolecularWeight: 338.89862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3

Isomeric SMILES

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCNCC3

InChI

InChI=1S/C16H23ClN4S/c1-3-11(4-2)22-16-19-13-9-12(17)15(10-14(13)20-16)21-7-5-18-6-8-21/h9-11,18H,3-8H2,1-2H3,(H,19,20)