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

Systemtic Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(1-phenylethyl)pentanamide Openeye Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(1-phenylethyl)pentanamide CAS Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(1-phenylethyl)pentanamide IUPAC Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(1-phenylethyl)pentanamide Traditional Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(1-phenylethyl)valeramide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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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)NC(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S2/c1-14(2)12-20(22(26)23-15(3)17-8-6-5-7-9-17)25-30(27,28)18-10-11-19-21(13-18)29-16(4)24-19/h5-11,13-15,20,25H,12H2,1-4H3,(H,23,26)