N-(4-ethoxyphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide

Systemtic Name: N-(4-ethoxyphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Openeye Name: N-(4-ethoxyphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide CAS Name: N-(4-ethoxyphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide IUPAC Name: N-(4-ethoxyphenyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Traditional Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-p-phenetyl-valeramide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

InChI

InChI=1S/C22H27N3O4S2/c1-5-29-17-8-6-16(7-9-17)24-22(26)20(12-14(2)3)25-31(27,28)18-10-11-19-21(13-18)30-15(4)23-19/h6-11,13-14,20,25H,5,12H2,1-4H3,(H,24,26)