2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-oxo-1-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-oxo-1-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]butan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[(6-phenoxy-1,3-benzothiazol-2-yl)carbamoyl]propyl]benzamide Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4S2/c1-32-22-11-7-6-10-19(22)24(30)27-21(14-15-34-2)25(31)29-26-28-20-13-12-18(16-23(20)35-26)33-17-8-4-3-5-9-17/h3-13,16,21H,14-15H2,1-2H3,(H,27,30)(H,28,29,31)