2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine

Systemtic Name: 2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine Openeye Name: 2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine CAS Name: 2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine IUPAC Name: 2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine Traditional Name: 2-[3-[4-[[(6-phenoxy-1,3-benzothiazol-2-yl)amino]methyl]phenoxy]propyl]guanidine Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NCC4=CC=C(C=C4)OCCCN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NCC4=CC=C(C=C4)OCCCN=C(N)N

InChI

InChI=1S/C24H25N5O2S/c25-23(26)27-13-4-14-30-18-9-7-17(8-10-18)16-28-24-29-21-12-11-20(15-22(21)32-24)31-19-5-2-1-3-6-19/h1-3,5-12,15H,4,13-14,16H2,(H,28,29)(H4,25,26,27)