4-[4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]phenyl]but-3-yn-1-ol

Systemtic Name: 4-[4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]phenyl]but-3-yn-1-ol Openeye Name: 4-[4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]methyl]phenyl]but-3-yn-1-ol CAS Name: 4-[4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidinyl]amino]methyl]phenyl]-3-butyn-1-ol IUPAC Name: 4-[4-[[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]methyl]phenyl]but-3-yn-1-ol Traditional Name: 4-[4-[[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]methyl]phenyl]but-3-yn-1-ol Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)NCC4=CC=C(C=C4)C#CCCO

Isomeric SMILES

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)NCC4=CC=C(C=C4)C#CCCO

InChI

InChI=1S/C23H25N3OS/c27-15-4-3-6-18-10-12-19(13-11-18)16-24-20-7-5-14-26(17-20)23-25-21-8-1-2-9-22(21)28-23/h1-2,8-13,20,24,27H,4-5,7,14-17H2