4-chloranyl-N-[[4-ethyl-5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[4-ethyl-5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-chloro-N-[[4-ethyl-5-(2-morpholino-2-oxo-ethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-chloro-N-[[4-ethyl-5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-chloro-N-[[4-ethyl-5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-chloro-N-[[4-ethyl-5-[(2-keto-2-morpholino-ethyl)thio]-1,2,4-triazol-3-yl]methyl]benzamide Formula: C18H22ClN5O3S MolecularWeight: 423.91698

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCOCC2)CNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCOCC2)CNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H22ClN5O3S/c1-2-24-15(11-20-17(26)13-3-5-14(19)6-4-13)21-22-18(24)28-12-16(25)23-7-9-27-10-8-23/h3-6H,2,7-12H2,1H3,(H,20,26)