2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-4,5-dimethyl-phenol

Systemtic Name: 2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-4,5-dimethyl-phenol Openeye Name: 2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-4,5-dimethyl-phenol CAS Name: 2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]methyl]-4,5-dimethylphenol IUPAC Name: 2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-4,5-dimethylphenol Traditional Name: 2-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazino]methyl]-4,5-dimethyl-phenol Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H27N3OS/c1-15-12-18(20(26)13-16(15)2)14-24-8-10-25(11-9-24)17(3)22-23-19-6-4-5-7-21(19)27-22/h4-7,12-13,17,26H,8-11,14H2,1-3H3