1-(3,4-dimethylphenyl)-2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(3,4-dimethylphenyl)-2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]propan-1-one Openeye Name: 1-(3,4-dimethylphenyl)-2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]propan-1-one CAS Name: 1-(3,4-dimethylphenyl)-2-[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-1-propanone IUPAC Name: 1-(3,4-dimethylphenyl)-2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]propan-1-one Traditional Name: 1-(3,4-dimethylphenyl)-2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]propan-1-one Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NNC(=C3C=NC4=CC=CC=C43)O2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NN/C(=C/3\C=NC4=CC=CC=C43)/O2)C

InChI

InChI=1S/C21H19N3O2S/c1-12-8-9-15(10-13(12)2)19(25)14(3)27-21-24-23-20(26-21)17-11-22-18-7-5-4-6-16(17)18/h4-11,14,23H,1-3H3/b20-17-