2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-1-ethyl-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 2-[(1-butyl-5-tetrazolyl)methylthio]-1-ethyl-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-1-ethyl-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 2-[(1-butyltetrazol-5-yl)methylthio]-1-ethyl-5-piperidinosulfonyl-benzimidazole Formula: C20H29N7O2S2 MolecularWeight: 463.61996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H29N7O2S2/c1-3-5-13-27-19(22-23-24-27)15-30-20-21-17-14-16(9-10-18(17)26(20)4-2)31(28,29)25-11-7-6-8-12-25/h9-10,14H,3-8,11-13,15H2,1-2H3