(3-chloranyl-4-fluoranyl-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3-chloranyl-4-fluoranyl-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3-chloro-4-fluoro-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (3-chloro-4-fluoro-1-benzothiophen-2-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-4-fluoro-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3-chloro-4-fluoro-benzothiophen-2-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H14ClFN4OS MolecularWeight: 376.835663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

InChI

InChI=1S/C17H14ClFN4OS/c18-14-13-11(19)3-1-4-12(13)25-15(14)16(24)22-7-9-23(10-8-22)17-20-5-2-6-21-17/h1-6H,7-10H2