(2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]oxolane-2-carboxamide

Systemtic Name: (2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]oxolane-2-carboxamide Openeye Name: (2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]tetrahydrofuran-2-carboxamide CAS Name: (2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-oxolanecarboxamide IUPAC Name: (2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]oxolane-2-carboxamide Traditional Name: (2S)-N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]tetrahydrofuran-2-carboxamide Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3COCCOC3)SC(=N2)NC(=O)C4CCCO4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3COCCOC3)SC(=N2)NC(=O)[C@@H]4CCCO4

InChI

InChI=1S/C18H22N2O5S/c1-22-13-5-4-12(11-9-23-7-8-24-10-11)16-15(13)19-18(26-16)20-17(21)14-3-2-6-25-14/h4-5,11,14H,2-3,6-10H2,1H3,(H,19,20,21)/t14-/m0/s1