4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-1-(4-fluorophenyl)butan-1-one Formula: C19H18FN3OS2 MolecularWeight: 387.494123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCCC(=O)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCCCC(=O)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C19H18FN3OS2/c20-14-7-5-13(6-8-14)16(24)3-1-12-26-19-22-21-18(17-4-2-11-25-17)23(19)15-9-10-15/h2,4-8,11,15H,1,3,9-10,12H2