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

Systemtic Name: 4-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[[4-cyclopropyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)butan-1-one Formula: C23H21FN4OS MolecularWeight: 420.502443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCCCC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCCCC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H21FN4OS/c24-16-9-7-15(8-10-16)21(29)6-3-13-30-23-27-26-22(28(23)17-11-12-17)19-14-25-20-5-2-1-4-18(19)20/h1-2,4-5,7-10,14,17,26H,3,6,11-13H2