3-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Openeye Name: 3-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one IUPAC Name: 3-[2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Traditional Name: 3-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H21N3O3S/c1-15-13-18(16(2)24(15)11-10-17-7-4-3-5-8-17)19(26)14-25-22(27)28-21(23-25)20-9-6-12-29-20/h3-9,12-13H,10-11,14H2,1-2H3