1-(1,3-benzothiazol-2-yl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-N-(3-keto-4H-1,4-benzoxazin-6-yl)isonipecotamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H20N4O3S/c26-19-12-28-17-6-5-14(11-16(17)23-19)22-20(27)13-7-9-25(10-8-13)21-24-15-3-1-2-4-18(15)29-21/h1-6,11,13H,7-10,12H2,(H,22,27)(H,23,26)