N'-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(2-oxidanylidenepiperidin-1-yl)phenyl]ethanediamide

Systemtic Name: N'-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(2-oxidanylidenepiperidin-1-yl)phenyl]ethanediamide Openeye Name: N'-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(2-oxo-1-piperidyl)phenyl]oxamide CAS Name: N'-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(2-oxo-1-piperidinyl)phenyl]oxamide IUPAC Name: N'-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(2-oxopiperidin-1-yl)phenyl]oxamide Traditional Name: N'-(1,3-benzothiazol-2-yl)-N-[3-(2-ketopiperidino)-4-methyl-phenyl]oxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NC2=NC3=CC=CC=C3S2)N4CCCCC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NC2=NC3=CC=CC=C3S2)N4CCCCC4=O

InChI

InChI=1S/C21H20N4O3S/c1-13-9-10-14(12-16(13)25-11-5-4-8-18(25)26)22-19(27)20(28)24-21-23-15-6-2-3-7-17(15)29-21/h2-3,6-7,9-10,12H,4-5,8,11H2,1H3,(H,22,27)(H,23,24,28)