2-ethoxy-N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide

Systemtic Name: 2-ethoxy-N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Openeye Name: 2-ethoxy-N-[2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]benzamide CAS Name: 2-ethoxy-N-[2-[[2-(methylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]benzamide IUPAC Name: 2-ethoxy-N-[2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]benzamide Traditional Name: 2-ethoxy-N-[2-[[2-keto-2-(methylamino)ethyl]thio]-4-phenyl-thiazol-5-yl]benzamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2=C(N=C(S2)SCC(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2=C(N=C(S2)SCC(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-3-27-16-12-8-7-11-15(16)19(26)24-20-18(14-9-5-4-6-10-14)23-21(29-20)28-13-17(25)22-2/h4-12H,3,13H2,1-2H3,(H,22,25)(H,24,26)