N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-methyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-methyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methylamino]-N-methylacetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methylamino]-N-methylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-methyl-acetamide Formula: C18H18FN3O3S2 MolecularWeight: 407.482223

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3O3S2/c1-21(11-17-20-15-5-3-4-6-16(15)26-17)18(23)12-22(2)27(24,25)14-9-7-13(19)8-10-14/h3-10H,11-12H2,1-2H3