N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-[(4-fluoranylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-[(4-fluoranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(4-fluorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Formula: C18H12ClFN4O2S MolecularWeight: 402.829883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)F

Isomeric SMILES

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)F

InChI

InChI=1S/C18H12ClFN4O2S/c19-11-1-6-14-16(9-11)27-18(21-14)22-17(25)15-7-8-24(23-15)10-26-13-4-2-12(20)3-5-13/h1-9H,10H2,(H,21,22,25)