N-[5-azanyl-3-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]thiomorpholine-4-carboxamide

Systemtic Name: N-[5-azanyl-3-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]thiomorpholine-4-carboxamide Openeye Name: N-[5-amino-3-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]thiomorpholine-4-carboxamide CAS Name: N-[5-amino-3-(4-chlorophenyl)-1-(4-fluorophenyl)-4-pyrazolyl]-4-thiomorpholinecarboxamide IUPAC Name: N-[5-amino-3-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]thiomorpholine-4-carboxamide Traditional Name: N-[5-amino-3-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]thiomorpholine-4-carboxamide Formula: C20H19ClFN5OS MolecularWeight: 431.914163

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F)N

Isomeric SMILES

C1CSCCN1C(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F)N

InChI

InChI=1S/C20H19ClFN5OS/c21-14-3-1-13(2-4-14)17-18(24-20(28)26-9-11-29-12-10-26)19(23)27(25-17)16-7-5-15(22)6-8-16/h1-8H,9-12,23H2,(H,24,28)