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

Systemtic Name: N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-4-(hydroxymethyl)piperidine-1-carboxamide Openeye Name: N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-4-(hydroxymethyl)piperidine-1-carboxamide CAS Name: N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-4-(hydroxymethyl)-1-piperidinecarboxamide IUPAC Name: N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-4-(hydroxymethyl)piperidine-1-carboxamide Traditional Name: N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]-4-methylol-piperidine-1-carboxamide Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3COCCOC3)SC(=N2)NC(=O)N4CCC(CC4)CO

Isomeric SMILES

COC1=C2C(=C(C=C1)C3COCCOC3)SC(=N2)NC(=O)N4CCC(CC4)CO

InChI

InChI=1S/C20H27N3O5S/c1-26-16-3-2-15(14-11-27-8-9-28-12-14)18-17(16)21-19(29-18)22-20(25)23-6-4-13(10-24)5-7-23/h2-3,13-14,24H,4-12H2,1H3,(H,21,22,25)