N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-4-chloranyl-2-fluoranyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-4-chloranyl-2-fluoranyl-benzamide Openeye Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-4-chloro-2-fluoro-benzamide CAS Name: N-[4-(1-azepanylmethyl)-2-thiazolyl]-4-chloro-2-fluorobenzamide IUPAC Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-4-chloro-2-fluorobenzamide Traditional Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-4-chloro-2-fluoro-benzamide Formula: C17H19ClFN3OS MolecularWeight: 367.868663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C1CCCN(CC1)CC2=CSC(=N2)NC(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C17H19ClFN3OS/c18-12-5-6-14(15(19)9-12)16(23)21-17-20-13(11-24-17)10-22-7-3-1-2-4-8-22/h5-6,9,11H,1-4,7-8,10H2,(H,20,21,23)