N-tert-butyl-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-oxidanyl-propyl]benzamide

Systemtic Name: N-tert-butyl-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-oxidanyl-propyl]benzamide Openeye Name: N-tert-butyl-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-hydroxy-propyl]benzamide CAS Name: N-tert-butyl-2-[3-[[2-[(2-dimethylaminoethylamino)-oxomethyl]phenyl]thio]-2-hydroxypropyl]benzamide IUPAC Name: N-tert-butyl-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-hydroxypropyl]benzamide Traditional Name: N-tert-butyl-2-[3-[[2-(2-dimethylaminoethylcarbamoyl)phenyl]thio]-2-hydroxy-propyl]benzamide Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1CC(CSC2=CC=CC=C2C(=O)NCCN(C)C)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1CC(CSC2=CC=CC=C2C(=O)NCCN(C)C)O

InChI

InChI=1S/C25H35N3O3S/c1-25(2,3)27-24(31)20-11-7-6-10-18(20)16-19(29)17-32-22-13-9-8-12-21(22)23(30)26-14-15-28(4)5/h6-13,19,29H,14-17H2,1-5H3,(H,26,30)(H,27,31)