4-decoxy-N-[2-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-decoxy-N-[2-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-decoxy-N-[2-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-decoxy-N-[2-[[2-oxo-2-(2-phenoxyethylamino)ethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-decoxy-N-[2-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-decoxy-N-[2-[[2-keto-2-(2-phenoxyethylamino)ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C34H41N3O4S2 MolecularWeight: 619.83704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCCOC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCCOC4=CC=CC=C4

InChI

InChI=1S/C34H41N3O4S2/c1-2-3-4-5-6-7-8-12-22-40-29-18-15-26(16-19-29)33(39)36-27-17-20-30-31(24-27)43-34(37-30)42-25-32(38)35-21-23-41-28-13-10-9-11-14-28/h9-11,13-20,24H,2-8,12,21-23,25H2,1H3,(H,35,38)(H,36,39)