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

Systemtic Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide CAS Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Traditional Name: N-benzyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]valeramide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3S2/c1-14(2)11-19(21(25)22-13-16-7-5-4-6-8-16)24-29(26,27)17-9-10-18-20(12-17)28-15(3)23-18/h4-10,12,14,19,24H,11,13H2,1-3H3,(H,22,25)