1-(4-tert-butylphenyl)-4-[4-(3-chloranylpyrazin-2-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-(4-tert-butylphenyl)-4-[4-(3-chloranylpyrazin-2-yl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-tert-butylphenyl)-4-[4-(3-chloropyrazin-2-yl)piperazin-1-yl]butan-1-one CAS Name: 1-(4-tert-butylphenyl)-4-[4-(3-chloro-2-pyrazinyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-(3-chloropyrazin-2-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-(4-tert-butylphenyl)-4-[4-(3-chloropyrazin-2-yl)piperazino]butan-1-one Formula: C22H29ClN4O MolecularWeight: 400.94486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCN(CC2)C3=NC=CN=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCN(CC2)C3=NC=CN=C3Cl

InChI

InChI=1S/C22H29ClN4O/c1-22(2,3)18-8-6-17(7-9-18)19(28)5-4-12-26-13-15-27(16-14-26)21-20(23)24-10-11-25-21/h6-11H,4-5,12-16H2,1-3H3