N-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-2,5-diethoxy-phenyl]benzamide

Systemtic Name: N-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-2,5-diethoxy-phenyl]benzamide Openeye Name: N-[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-2,5-diethoxy-phenyl]benzamide CAS Name: N-[4-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-2,5-diethoxyphenyl]benzamide IUPAC Name: N-[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-2,5-diethoxyphenyl]benzamide Traditional Name: N-[4-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]-2,5-diethoxy-phenyl]benzamide Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C26H25N3O4S2/c1-3-32-21-15-20(28-25(31)17-10-6-5-7-11-17)22(33-4-2)14-19(21)27-24(30)16-34-26-29-18-12-8-9-13-23(18)35-26/h5-15H,3-4,16H2,1-2H3,(H,27,30)(H,28,31)