(2S,3S,6R)-2-methyl-6-[3-(2-phenyl-1-benzothiophen-3-yl)prop-2-ynoxy]oxan-3-amine

Systemtic Name: (2S,3S,6R)-2-methyl-6-[3-(2-phenyl-1-benzothiophen-3-yl)prop-2-ynoxy]oxan-3-amine Openeye Name: (2S,3S,6R)-2-methyl-6-[3-(2-phenylbenzothiophen-3-yl)prop-2-ynoxy]tetrahydropyran-3-amine CAS Name: (2S,3S,6R)-2-methyl-6-[3-(2-phenyl-1-benzothiophen-3-yl)prop-2-ynoxy]-3-oxanamine IUPAC Name: (2S,3S,6R)-2-methyl-6-[3-(2-phenyl-1-benzothiophen-3-yl)prop-2-ynoxy]oxan-3-amine Traditional Name: [(2S,3S,6R)-2-methyl-6-[3-(2-phenylbenzothiophen-3-yl)prop-2-ynoxy]tetrahydropyran-3-yl]amine Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC(O1)OCC#CC2=C(SC3=CC=CC=C32)C4=CC=CC=C4)N

Isomeric SMILES

C[C@H]1[C@H](CC[C@@H](O1)OCC#CC2=C(SC3=CC=CC=C32)C4=CC=CC=C4)N

InChI

InChI=1S/C23H23NO2S/c1-16-20(24)13-14-22(26-16)25-15-7-11-19-18-10-5-6-12-21(18)27-23(19)17-8-3-2-4-9-17/h2-6,8-10,12,16,20,22H,13-15,24H2,1H3/t16-,20-,22+/m0/s1