N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-cyanophenyl)methylsulfonyl]-N-methyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-cyanophenyl)methylsulfonyl]-N-methyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-cyanophenyl)methylsulfonyl]-N-methyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-cyanophenyl)methylsulfonyl]-N-methylacetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-cyanophenyl)methylsulfonyl]-N-methylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-cyanobenzyl)sulfonyl-N-methyl-acetamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)CS(=O)(=O)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)CS(=O)(=O)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N3O3S2/c1-22(11-18-21-16-4-2-3-5-17(16)26-18)19(23)13-27(24,25)12-15-8-6-14(10-20)7-9-15/h2-9H,11-13H2,1H3