(2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methyl-butanamide

Systemtic Name: (2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methyl-butanamide Openeye Name: (2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-ylidene]-2-methyl-butanamide CAS Name: (2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-ylidene]-2-methylbutanamide IUPAC Name: (2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylbutanamide Traditional Name: (2S)-N-[(3aS,6aR)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-diketo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-ylidene]-2-methyl-butyramide Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N=C1N(C2CS(=O)(=O)CC2S1)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC[C@H](C)C(=O)N=C1N([C@H]2CS(=O)(=O)C[C@@H]2S1)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H22N2O5S2/c1-3-11(2)17(21)19-18-20(13-9-27(22,23)10-16(13)26-18)12-4-5-14-15(8-12)25-7-6-24-14/h4-5,8,11,13,16H,3,6-7,9-10H2,1-2H3/t11-,13-,16-/m0/s1