[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-pyrazin-2-ylpiperidin-3-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-pyrazin-2-ylpiperidin-3-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(1-pyrazin-2-yl-3-piperidyl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[1-(2-pyrazinyl)-3-piperidinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(1-pyrazin-2-ylpiperidin-3-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(1-pyrazin-2-yl-3-piperidyl)methanone Formula: C21H26ClN5O MolecularWeight: 399.91704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C21H26ClN5O/c1-16-4-5-18(22)13-19(16)25-9-11-26(12-10-25)21(28)17-3-2-8-27(15-17)20-14-23-6-7-24-20/h4-7,13-14,17H,2-3,8-12,15H2,1H3