2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone

Systemtic Name: 2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone Openeye Name: 2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazin-1-yl]methanone CAS Name: 2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]methanone IUPAC Name: 2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone Traditional Name: 2H-benzotriazol-5-yl-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazino]methanone Formula: C22H20ClN5OS MolecularWeight: 437.9451

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)C4=CC5=NNN=C5C=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)C4=CC5=NNN=C5C=C4

InChI

InChI=1S/C22H20ClN5OS/c23-17-3-1-2-15(12-17)21-7-5-18(30-21)14-27-8-10-28(11-9-27)22(29)16-4-6-19-20(13-16)25-26-24-19/h1-7,12-13H,8-11,14H2,(H,24,25,26)