4-[5-[4-(5-butyl-2-tert-butyl-1,3-thiazol-4-yl)phenoxy]pentoxy]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[5-[4-(5-butyl-2-tert-butyl-1,3-thiazol-4-yl)phenoxy]pentoxy]-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-[5-[4-(5-butyl-2-tert-butyl-thiazol-4-yl)phenoxy]pentoxy]-N'-hydroxy-benzamidine CAS Name: 4-[5-[4-(5-butyl-2-tert-butyl-4-thiazolyl)phenoxy]pentoxy]-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-[5-[4-(5-butyl-2-tert-butyl-1,3-thiazol-4-yl)phenoxy]pentoxy]-N'-hydroxybenzenecarboximidamide Traditional Name: 4-[5-[4-(5-butyl-2-tert-butyl-thiazol-4-yl)phenoxy]pentoxy]-N'-hydroxy-benzamidine Formula: C29H39N3O3S MolecularWeight: 509.70326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(S1)C(C)(C)C)C2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)C(=NO)N

Isomeric SMILES

CCCCC1=C(N=C(S1)C(C)(C)C)C2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)/C(=N/O)/N

InChI

InChI=1S/C29H39N3O3S/c1-5-6-10-25-26(31-28(36-25)29(2,3)4)21-11-15-23(16-12-21)34-19-8-7-9-20-35-24-17-13-22(14-18-24)27(30)32-33/h11-18,33H,5-10,19-20H2,1-4H3,(H2,30,32)