N-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]-N-(phenylmethyl)ethanamide

Systemtic Name: N-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-methyl-acetamide CAS Name: N-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-methylacetamide Traditional Name: N-benzyl-2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-methyl-acetamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3S2/c1-19-26-23-14-13-22(15-24(23)32-19)33(30,31)28(17-21-11-7-4-8-12-21)18-25(29)27(2)16-20-9-5-3-6-10-20/h3-15H,16-18H2,1-2H3