6-chloranyl-5-(4-ethyl-1,4-diazepan-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole

Systemtic Name: 6-chloranyl-5-(4-ethyl-1,4-diazepan-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole Openeye Name: 6-chloro-5-(4-ethyl-1,4-diazepan-1-yl)-2-(1-ethylpropylsulfanyl)-1H-benzimidazole CAS Name: 6-chloro-5-(4-ethyl-1,4-diazepan-1-yl)-2-(pentan-3-ylthio)-1H-benzimidazole IUPAC Name: 6-chloro-5-(4-ethyl-1,4-diazepan-1-yl)-2-pentan-3-ylsulfanyl-1H-benzimidazole Traditional Name: 6-chloro-5-(4-ethyl-1,4-diazepan-1-yl)-2-(1-ethylpropylthio)-1H-benzimidazole Formula: C19H29ClN4S MolecularWeight: 380.97836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCCN(CC3)CC

Isomeric SMILES

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)N3CCCN(CC3)CC

InChI

InChI=1S/C19H29ClN4S/c1-4-14(5-2)25-19-21-16-12-15(20)18(13-17(16)22-19)24-9-7-8-23(6-3)10-11-24/h12-14H,4-11H2,1-3H3,(H,21,22)