2-[[2,5-dimethyl-4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzenecarbonitrile

Systemtic Name: 2-[[2,5-dimethyl-4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzenecarbonitrile Openeye Name: 2-[[2,5-dimethyl-4-(thiazol-2-ylmethyl)piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzonitrile CAS Name: 2-[[2,5-dimethyl-4-(2-thiazolylmethyl)-1-piperazinyl]-(3-hydroxyphenyl)methyl]benzonitrile IUPAC Name: 2-[[2,5-dimethyl-4-(1,3-thiazol-2-ylmethyl)piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzonitrile Traditional Name: 2-[[2,5-dimethyl-4-(thiazol-2-ylmethyl)piperazino]-(3-hydroxyphenyl)methyl]benzonitrile Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(C2=CC(=CC=C2)O)C3=CC=CC=C3C#N)C)CC4=NC=CS4

Isomeric SMILES

CC1CN(C(CN1C(C2=CC(=CC=C2)O)C3=CC=CC=C3C#N)C)CC4=NC=CS4

InChI

InChI=1S/C24H26N4OS/c1-17-15-28(18(2)14-27(17)16-23-26-10-11-30-23)24(19-7-5-8-21(29)12-19)22-9-4-3-6-20(22)13-25/h3-12,17-18,24,29H,14-16H2,1-2H3