5-[(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole

Systemtic Name: 5-[(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole Openeye Name: 5-[[1-butyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylmethyl]-2-phenyl-thiazole CAS Name: 5-[[[1-butyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]methyl]-2-phenylthiazole IUPAC Name: 5-[(1-butyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole Traditional Name: 5-[[(1-butyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]methyl]-2-phenyl-thiazole Formula: C26H30N4O2S3 MolecularWeight: 526.737

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CN=C(S4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CN=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C26H30N4O2S3/c1-2-3-16-30-24-13-12-22(35(31,32)29-14-8-5-9-15-29)17-23(24)28-26(30)33-19-21-18-27-25(34-21)20-10-6-4-7-11-20/h4,6-7,10-13,17-18H,2-3,5,8-9,14-16,19H2,1H3