1-(5-bromanylthiophen-2-yl)-3-[4-[(2-chloranyl-6-methyl-pyridin-4-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-3-[4-[(2-chloranyl-6-methyl-pyridin-4-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 1-(5-bromo-2-thienyl)-3-[4-[(2-chloro-6-methyl-4-pyridyl)methyl]piperazin-1-yl]propan-1-one CAS Name: 1-(5-bromo-2-thiophenyl)-3-[4-[(2-chloro-6-methyl-4-pyridinyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-(5-bromothiophen-2-yl)-3-[4-[(2-chloro-6-methylpyridin-4-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 1-(5-bromo-2-thienyl)-3-[4-[(2-chloro-6-methyl-4-pyridyl)methyl]piperazino]propan-1-one Formula: C18H21BrClN3OS MolecularWeight: 442.80084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)CN2CCN(CC2)CCC(=O)C3=CC=C(S3)Br)Cl

Isomeric SMILES

CC1=NC(=CC(=C1)CN2CCN(CC2)CCC(=O)C3=CC=C(S3)Br)Cl

InChI

InChI=1S/C18H21BrClN3OS/c1-13-10-14(11-18(20)21-13)12-23-8-6-22(7-9-23)5-4-15(24)16-2-3-17(19)25-16/h2-3,10-11H,4-9,12H2,1H3