N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C20H22FN3O4S2 MolecularWeight: 451.534783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O4S2/c1-3-28-15-8-11-17-18(13-15)29-20(22-17)23-19(25)5-4-12-24(2)30(26,27)16-9-6-14(21)7-10-16/h6-11,13H,3-5,12H2,1-2H3,(H,22,23,25)