2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methylsulfanyl-N-(4-phenylmethoxyphenyl)butanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methylsulfanyl-N-(4-phenylmethoxyphenyl)butanamide Openeye Name: N-(4-benzyloxyphenyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)-N-(4-phenylmethoxyphenyl)butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-N-(4-phenylmethoxyphenyl)butanamide Traditional Name: N-(4-benzoxyphenyl)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)butyramide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CSCCC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C25H25N3O4S2/c1-33-16-15-22(27-24-21-9-5-6-10-23(21)34(30,31)28-24)25(29)26-19-11-13-20(14-12-19)32-17-18-7-3-2-4-8-18/h2-14,22H,15-17H2,1H3,(H,26,29)(H,27,28)