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

Systemtic Name: tert-butyl N-[5-[5-[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate Openeye Name: tert-butyl N-[5-[5-[2-(3-chloroanilino)-2-oxo-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate CAS Name: N-[5-[5-[[2-(3-chloroanilino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]pentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[5-[2-(3-chloroanilino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate Traditional Name: N-[5-[5-[[2-(3-chloroanilino)-2-keto-ethyl]thio]-1,3,4-oxadiazol-2-yl]pentyl]carbamic acid tert-butyl ester Formula: C20H27ClN4O4S MolecularWeight: 454.97078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCC1=NN=C(O1)SCC(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCC1=NN=C(O1)SCC(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H27ClN4O4S/c1-20(2,3)29-18(27)22-11-6-4-5-10-17-24-25-19(28-17)30-13-16(26)23-15-9-7-8-14(21)12-15/h7-9,12H,4-6,10-11,13H2,1-3H3,(H,22,27)(H,23,26)