N-[4-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methylamino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylamino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methylamino]-4-keto-butyl]thiophene-2-carboxamide Formula: C25H23FN4O2S MolecularWeight: 462.539123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)CCCNC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)CCCNC(=O)C4=CC=CS4

InChI

InChI=1S/C25H23FN4O2S/c26-20-12-10-18(11-13-20)24-19(17-30(29-24)21-6-2-1-3-7-21)16-28-23(31)9-4-14-27-25(32)22-8-5-15-33-22/h1-3,5-8,10-13,15,17H,4,9,14,16H2,(H,27,32)(H,28,31)