N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-benzylpiperazino)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C20H21FN4OS/c21-16-6-7-17-18(12-16)27-20(22-17)23-19(26)14-25-10-8-24(9-11-25)13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,22,23,26)