N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)-1,2-thiazol-5-yl]amino]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)-1,2-thiazol-5-yl]amino]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)isothiazol-5-yl]amino]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)-5-isothiazolyl]amino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)-1,2-thiazol-5-yl]amino]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[[3-methyl-4-(4-sulfamoylphenyl)isothiazol-5-yl]amino]valeramide Formula: C18H23N5O3S2 MolecularWeight: 421.53692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C2=CC=C(C=C2)S(=O)(=O)N)NC(CC(C)C)C(=O)NCC#N

Isomeric SMILES

CC1=NSC(=C1C2=CC=C(C=C2)S(=O)(=O)N)NC(CC(C)C)C(=O)NCC#N

InChI

InChI=1S/C18H23N5O3S2/c1-11(2)10-15(17(24)21-9-8-19)22-18-16(12(3)23-27-18)13-4-6-14(7-5-13)28(20,25)26/h4-7,11,15,22H,9-10H2,1-3H3,(H,21,24)(H2,20,25,26)