N-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-fluoranyl-benzamide

Systemtic Name: N-(2-azanyl-3-propan-2-ylsulfonyl-benzimidazol-5-yl)-4-fluoranyl-benzamide Openeye Name: N-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-fluoro-benzamide CAS Name: N-(2-amino-3-propan-2-ylsulfonyl-5-benzimidazolyl)-4-fluorobenzamide IUPAC Name: N-(2-amino-3-propan-2-ylsulfonylbenzimidazol-5-yl)-4-fluorobenzamide Traditional Name: N-(2-amino-3-isopropylsulfonyl-benzimidazol-5-yl)-4-fluoro-benzamide Formula: C17H17FN4O3S MolecularWeight: 376.405283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)F)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)F)N=C1N

InChI

InChI=1S/C17H17FN4O3S/c1-10(2)26(24,25)22-15-9-13(7-8-14(15)21-17(22)19)20-16(23)11-3-5-12(18)6-4-11/h3-10H,1-2H3,(H2,19,21)(H,20,23)