1-(4-bromophenyl)-4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butan-1-one Openeye Name: 1-(4-bromophenyl)-4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butan-1-one CAS Name: 1-(4-bromophenyl)-4-[[2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]butan-1-one Traditional Name: 1-(4-bromophenyl)-4-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)thio]butan-1-one Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3NN=C(O3)SCCCC(=O)C4=CC=C(C=C4)Br)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3NN=C(O3)SCCCC(=O)C4=CC=C(C=C4)Br)C=N2

InChI

InChI=1S/C20H16BrN3O2S/c21-14-9-7-13(8-10-14)18(25)6-3-11-27-20-24-23-19(26-20)16-12-22-17-5-2-1-4-15(16)17/h1-2,4-5,7-10,12,23H,3,6,11H2