2-[(S)-(tert-butylsulfinylamino)-deuterio-naphthalen-2-yl-methyl]-N-ethyl-1,3-dithiolane-2-carboxamide

Systemtic Name: 2-[(S)-(tert-butylsulfinylamino)-deuterio-naphthalen-2-yl-methyl]-N-ethyl-1,3-dithiolane-2-carboxamide Openeye Name: 2-[(S)-(tert-butylsulfinylamino)-deuterio-(2-naphthyl)methyl]-N-ethyl-1,3-dithiolane-2-carboxamide CAS Name: 2-[(S)-(tert-butylsulfinylamino)-deuterio-(2-naphthalenyl)methyl]-N-ethyl-1,3-dithiolane-2-carboxamide IUPAC Name: 2-[(S)-(tert-butylsulfinylamino)-deuterio-naphthalen-2-ylmethyl]-N-ethyl-1,3-dithiolane-2-carboxamide Traditional Name: 2-[(S)-(tert-butylsulfinylamino)-deuterio-(2-naphthyl)methyl]-N-ethyl-1,3-dithiolane-2-carboxamide Formula: C21H28N2O2S3 MolecularWeight: 437.660382

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1(SCCS1)C(C2=CC3=CC=CC=C3C=C2)NS(=O)C(C)(C)C

Isomeric SMILES

[2H][C@](C1=CC2=CC=CC=C2C=C1)(C3(SCCS3)C(=O)NCC)NS(=O)C(C)(C)C

InChI

InChI=1S/C21H28N2O2S3/c1-5-22-19(24)21(26-12-13-27-21)18(23-28(25)20(2,3)4)17-11-10-15-8-6-7-9-16(15)14-17/h6-11,14,18,23H,5,12-13H2,1-4H3,(H,22,24)/t18-,28?/m0/s1/i18D