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

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide CAS Name: N-[(4-fluorophenyl)methyl]-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Traditional Name: N-(4-fluorobenzyl)-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]valeramide Formula: C21H24FN3O3S2 MolecularWeight: 449.561963

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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=C(C=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C21H24FN3O3S2/c1-13(2)10-19(21(26)23-12-15-4-6-16(22)7-5-15)25-30(27,28)17-8-9-18-20(11-17)29-14(3)24-18/h4-9,11,13,19,25H,10,12H2,1-3H3,(H,23,26)