(3S,4R)-N-butyl-1,1-bis(oxidanylidene)-4-(4-propan-2-yloxyphenyl)sulfonyl-thiolan-3-amine

Systemtic Name: (3S,4R)-N-butyl-1,1-bis(oxidanylidene)-4-(4-propan-2-yloxyphenyl)sulfonyl-thiolan-3-amine Openeye Name: (3S,4R)-N-butyl-4-(4-isopropoxyphenyl)sulfonyl-1,1-dioxo-thiolan-3-amine CAS Name: (3S,4R)-N-butyl-1,1-dioxo-4-(4-propan-2-yloxyphenyl)sulfonyl-3-thiolanamine IUPAC Name: (3S,4R)-N-butyl-1,1-dioxo-4-(4-propan-2-yloxyphenyl)sulfonylthiolan-3-amine Traditional Name: butyl-[(3S,4R)-4-(4-isopropoxyphenyl)sulfonyl-1,1-diketo-thiolan-3-yl]amine Formula: C17H27NO5S2 MolecularWeight: 389.52998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1CS(=O)(=O)CC1S(=O)(=O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCCCN[C@H]1CS(=O)(=O)C[C@@H]1S(=O)(=O)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C17H27NO5S2/c1-4-5-10-18-16-11-24(19,20)12-17(16)25(21,22)15-8-6-14(7-9-15)23-13(2)3/h6-9,13,16-18H,4-5,10-12H2,1-3H3/t16-,17-/m0/s1