N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]phenyl]pentanamide IUPAC Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]thio]phenyl]valeramide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

InChI

InChI=1S/C22H25N3O3S2/c1-3-5-6-20(26)23-15-7-10-17(11-8-15)29-14-21(27)25-22-24-18-12-9-16(28-4-2)13-19(18)30-22/h7-13H,3-6,14H2,1-2H3,(H,23,26)(H,24,25,27)