2H-benzotriazol-5-yl-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 2H-benzotriazol-5-yl-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: 2H-benzotriazol-5-yl-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]methanone CAS Name: 2H-benzotriazol-5-yl-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 2H-benzotriazol-5-yl-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 2H-benzotriazol-5-yl-[4-(4-isopropylbenzyl)piperazino]methanone Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C21H25N5O/c1-15(2)17-5-3-16(4-6-17)14-25-9-11-26(12-10-25)21(27)18-7-8-19-20(13-18)23-24-22-19/h3-8,13,15H,9-12,14H2,1-2H3,(H,22,23,24)