(2R)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-naphthalen-1-ylethanoylamino)butanamide

Systemtic Name: (2R)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2-naphthalen-1-ylethanoylamino)butanamide Openeye Name: (2R)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[[2-(1-naphthyl)acetyl]amino]butanamide CAS Name: (2R)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanamide IUPAC Name: (2R)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[(2-naphthalen-1-ylacetyl)amino]butanamide Traditional Name: (2R)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyramide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@H](C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H25N3O4S2/c1-15(2)23(27-22(29)13-17-9-6-8-16-7-4-5-10-19(16)17)24(30)28-25-26-20-12-11-18(34(3,31)32)14-21(20)33-25/h4-12,14-15,23H,13H2,1-3H3,(H,27,29)(H,26,28,30)/t23-/m1/s1