N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: N-benzyl-2-benzylsulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: N-benzyl-2-benzylsulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-benzyl-2-benzylsulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C25H24N2O3S2 MolecularWeight: 464.59966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CS(=O)(=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CS(=O)(=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H24N2O3S2/c1-18-13-19(2)24-22(14-18)26-25(31-24)27(15-20-9-5-3-6-10-20)23(28)17-32(29,30)16-21-11-7-4-8-12-21/h3-14H,15-17H2,1-2H3