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

Systemtic Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylsulfanylphenyl)pentanamide Openeye Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylsulfanylphenyl)pentanamide CAS Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-[3-(methylthio)phenyl]pentanamide IUPAC Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylsulfanylphenyl)pentanamide Traditional Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-[3-(methylthio)phenyl]valeramide Formula: C21H25N3O3S3 MolecularWeight: 463.6365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC(C)C)C(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H25N3O3S3/c1-13(2)10-19(21(25)23-15-6-5-7-16(11-15)28-4)24-30(26,27)17-8-9-18-20(12-17)29-14(3)22-18/h5-9,11-13,19,24H,10H2,1-4H3,(H,23,25)