N-(1,3-benzothiazol-2-yl)-1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[2-(4-fluoroanilino)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[2-(4-fluoroanilino)-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-[2-(4-fluoroanilino)-2-oxoethyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[2-(4-fluoroanilino)-2-keto-ethyl]isonipecotamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O2S/c22-15-5-7-16(8-6-15)23-19(27)13-26-11-9-14(10-12-26)20(28)25-21-24-17-3-1-2-4-18(17)29-21/h1-8,14H,9-13H2,(H,23,27)(H,24,25,28)