N-(1,3-benzothiazol-2-ylmethyl)-4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(2-chloro-6-fluorophenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(2-chloro-6-fluoro-benzyl)piperazine-1-carboxamide Formula: C20H20ClFN4OS MolecularWeight: 418.915403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)F)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)F)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20ClFN4OS/c21-15-4-3-5-16(22)14(15)13-25-8-10-26(11-9-25)20(27)23-12-19-24-17-6-1-2-7-18(17)28-19/h1-7H,8-13H2,(H,23,27)