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

Systemtic Name: N-cycloheptyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Openeye Name: N-cycloheptyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide CAS Name: N-cycloheptyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide IUPAC Name: N-cycloheptyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]pentanamide Traditional Name: N-cycloheptyl-4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]valeramide Formula: C21H31N3O3S2 MolecularWeight: 437.61914

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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)NC3CCCCCC3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H31N3O3S2/c1-14(2)12-19(21(25)23-16-8-6-4-5-7-9-16)24-29(26,27)17-10-11-18-20(13-17)28-15(3)22-18/h10-11,13-14,16,19,24H,4-9,12H2,1-3H3,(H,23,25)