N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[[4-[(2-phenoxyacetyl)amino]phenyl]thio]propionamide Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4S2/c1-3-32-20-11-14-22-23(15-20)35-26(28-22)29-25(31)17(2)34-21-12-9-18(10-13-21)27-24(30)16-33-19-7-5-4-6-8-19/h4-15,17H,3,16H2,1-2H3,(H,27,30)(H,28,29,31)