methyl 4-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropyl-carbamothioyl]amino]butanoate

Systemtic Name: methyl 4-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropyl-carbamothioyl]amino]butanoate Openeye Name: methyl 4-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropyl-carbamothioyl]amino]butanoate CAS Name: 4-[[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropylamino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropylcarbamothioyl]amino]butanoate Traditional Name: 4-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-cyclopropyl-thiocarbamoyl]amino]butyric acid methyl ester Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)N(CC1=NN=C(O1)C2=CC=C(C=C2)Cl)C3CC3

Isomeric SMILES

COC(=O)CCCNC(=S)N(CC1=NN=C(O1)C2=CC=C(C=C2)Cl)C3CC3

InChI

InChI=1S/C18H21ClN4O3S/c1-25-16(24)3-2-10-20-18(27)23(14-8-9-14)11-15-21-22-17(26-15)12-4-6-13(19)7-5-12/h4-7,14H,2-3,8-11H2,1H3,(H,20,27)