3-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)phenol

Systemtic Name: 3-(1-butyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)phenol Openeye Name: 3-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)phenol CAS Name: 3-[1-butyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]phenol IUPAC Name: 3-(1-butyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)phenol Traditional Name: 3-(1-butyl-5-morpholinosulfonyl-benzimidazol-2-yl)phenol Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C4=CC(=CC=C4)O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1C4=CC(=CC=C4)O

InChI

InChI=1S/C21H25N3O4S/c1-2-3-9-24-20-8-7-18(29(26,27)23-10-12-28-13-11-23)15-19(20)22-21(24)16-5-4-6-17(25)14-16/h4-8,14-15,25H,2-3,9-13H2,1H3