2-butyl-5-piperazin-1-yl-4-pyrimidin-2-yl-benzotriazole

Systemtic Name: 2-butyl-5-piperazin-1-yl-4-pyrimidin-2-yl-benzotriazole Openeye Name: 2-butyl-5-piperazin-1-yl-4-pyrimidin-2-yl-benzotriazole CAS Name: 2-butyl-5-(1-piperazinyl)-4-(2-pyrimidinyl)benzotriazole IUPAC Name: 2-butyl-5-piperazin-1-yl-4-pyrimidin-2-ylbenzotriazole Traditional Name: 2-butyl-5-piperazino-4-(2-pyrimidyl)benzotriazole Formula: C18H23N7 MolecularWeight: 337.42212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C2C=CC(=C(C2=N1)C3=NC=CC=N3)N4CCNCC4

Isomeric SMILES

CCCCN1N=C2C=CC(=C(C2=N1)C3=NC=CC=N3)N4CCNCC4

InChI

InChI=1S/C18H23N7/c1-2-3-11-25-22-14-5-6-15(24-12-9-19-10-13-24)16(17(14)23-25)18-20-7-4-8-21-18/h4-8,19H,2-3,9-13H2,1H3