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

Systemtic Name: 4-tert-butyl-N-[4-[4-methyl-5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[4-methyl-5-(2-morpholino-2-oxo-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[4-methyl-5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[4-methyl-5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[5-[(2-keto-2-morpholino-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC(=O)N4CCOCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC(=O)N4CCOCC4

InChI

InChI=1S/C26H31N5O3S/c1-26(2,3)20-9-5-19(6-10-20)24(33)27-21-11-7-18(8-12-21)23-28-29-25(30(23)4)35-17-22(32)31-13-15-34-16-14-31/h5-12H,13-17H2,1-4H3,(H,27,33)