3-(benzotriazol-1-yl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(benzotriazol-1-yl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(benzotriazol-1-yl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1-benzotriazolyl)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(benzotriazol-1-yl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(benzotriazol-1-yl)-1-[4-(2,3-dimethylphenyl)piperazino]propan-1-one Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCN3C4=CC=CC=C4N=N3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCN3C4=CC=CC=C4N=N3)C

InChI

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