3-[(2R,3R,4R)-6-azanyl-2-(dimethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-6-methyl-1,3-benzoxazole-2-thione

Systemtic Name: 3-[(2R,3R,4R)-6-azanyl-2-(dimethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-6-methyl-1,3-benzoxazole-2-thione Openeye Name: 3-[(2R,3R,4R)-6-amino-2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-6-methyl-1,3-benzoxazole-2-thione CAS Name: 3-[(2R,3R,4R)-6-amino-2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-6-methyl-1,3-benzoxazole-2-thione IUPAC Name: 3-[(2R,3R,4R)-6-amino-2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]-6-methyl-1,3-benzoxazole-2-thione Traditional Name: 3-[(2R,3R,4R)-6-amino-2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-6-methyl-1,3-benzoxazole-2-thione Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=S)O2)C3C(C(OC4=C3C=C(C=C4)N)(C)C(OC)OC)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=S)O2)[C@H]3[C@H]([C@](OC4=C3C=C(C=C4)N)(C)C(OC)OC)O

InChI

InChI=1S/C21H24N2O5S/c1-11-5-7-14-16(9-11)27-20(29)23(14)17-13-10-12(22)6-8-15(13)28-21(2,18(17)24)19(25-3)26-4/h5-10,17-19,24H,22H2,1-4H3/t17-,18-,21-/m1/s1