2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=CC=C2NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C22H23ClN4O3S/c1-3-20-26-27-22(31-20)25-21(29)16-7-4-5-8-17(16)24-19(28)9-6-12-30-18-11-10-15(23)13-14(18)2/h4-5,7-8,10-11,13H,3,6,9,12H2,1-2H3,(H,24,28)(H,25,27,29)