N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)butyramide Formula: C22H24N4O6S3 MolecularWeight: 536.64416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

InChI

InChI=1S/C22H24N4O6S3/c1-4-31-13-5-7-15-19(11-13)34-21(23-15)24-20(27)16(9-10-33-3)25-35(29,30)14-6-8-17-18(12-14)32-22(28)26(17)2/h5-8,11-12,16,25H,4,9-10H2,1-3H3,(H,23,24,27)