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

Systemtic Name: N-(2-dimethylaminoethyl)-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-oxidanyl-propyl]benzamide Openeye Name: N-(2-dimethylaminoethyl)-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-hydroxy-propyl]benzamide CAS Name: N-(2-dimethylaminoethyl)-2-[3-[[2-[(2-dimethylaminoethylamino)-oxomethyl]phenyl]thio]-2-hydroxypropyl]benzamide IUPAC Name: N-(2-dimethylaminoethyl)-2-[3-[2-(2-dimethylaminoethylcarbamoyl)phenyl]sulfanyl-2-hydroxypropyl]benzamide Traditional Name: N-(2-dimethylaminoethyl)-2-[3-[[2-(2-dimethylaminoethylcarbamoyl)phenyl]thio]-2-hydroxy-propyl]benzamide Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=CC=C1CC(CSC2=CC=CC=C2C(=O)NCCN(C)C)O

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=CC=C1CC(CSC2=CC=CC=C2C(=O)NCCN(C)C)O

InChI

InChI=1S/C25H36N4O3S/c1-28(2)15-13-26-24(31)21-10-6-5-9-19(21)17-20(30)18-33-23-12-8-7-11-22(23)25(32)27-14-16-29(3)4/h5-12,20,30H,13-18H2,1-4H3,(H,26,31)(H,27,32)