4-tert-butyl-N-[4-methylsulfanyl-1-[[4-(morpholin-4-ylmethyl)phenyl]methylamino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-methylsulfanyl-1-[[4-(morpholin-4-ylmethyl)phenyl]methylamino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[3-methylsulfanyl-1-[[4-(morpholinomethyl)phenyl]methylcarbamoyl]propyl]benzamide CAS Name: 4-tert-butyl-N-[4-(methylthio)-1-[[4-(4-morpholinylmethyl)phenyl]methylamino]-1-oxobutan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[4-methylsulfanyl-1-[[4-(morpholin-4-ylmethyl)phenyl]methylamino]-1-oxobutan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[3-(methylthio)-1-[[4-(morpholinomethyl)benzyl]carbamoyl]propyl]benzamide Formula: C28H39N3O3S MolecularWeight: 497.69256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)CN3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)CN3CCOCC3

InChI

InChI=1S/C28H39N3O3S/c1-28(2,3)24-11-9-23(10-12-24)26(32)30-25(13-18-35-4)27(33)29-19-21-5-7-22(8-6-21)20-31-14-16-34-17-15-31/h5-12,25H,13-20H2,1-4H3,(H,29,33)(H,30,32)