tert-butyl N-[1-[5-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-3-methyl-butyl]carbamate

Systemtic Name: tert-butyl N-[1-[5-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-3-methyl-butyl]carbamate Openeye Name: tert-butyl N-[1-[5-[2-(2,6-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-3-methyl-butyl]carbamate CAS Name: N-[1-[5-[[2-(2,6-dimethylanilino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]-3-methylbutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[5-[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-3-methylbutyl]carbamate Traditional Name: N-[1-[5-[[2-(2,6-dimethylanilino)-2-keto-ethyl]thio]-1,3,4-oxadiazol-2-yl]-3-methyl-butyl]carbamic acid tert-butyl ester Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(O2)C(CC(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(O2)C(CC(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H32N4O4S/c1-13(2)11-16(23-20(28)30-22(5,6)7)19-25-26-21(29-19)31-12-17(27)24-18-14(3)9-8-10-15(18)4/h8-10,13,16H,11-12H2,1-7H3,(H,23,28)(H,24,27)