(3-azanylpyrrolidin-1-yl)-[6-[(4-ethynyl-2-methyl-phenyl)amino]-7-fluoranyl-3H-benzimidazol-5-yl]methanone

Systemtic Name: (3-azanylpyrrolidin-1-yl)-[6-[(4-ethynyl-2-methyl-phenyl)amino]-7-fluoranyl-3H-benzimidazol-5-yl]methanone Openeye Name: (3-aminopyrrolidin-1-yl)-[6-(4-ethynyl-2-methyl-anilino)-7-fluoro-3H-benzimidazol-5-yl]methanone CAS Name: (3-amino-1-pyrrolidinyl)-[6-(4-ethynyl-2-methylanilino)-7-fluoro-3H-benzimidazol-5-yl]methanone IUPAC Name: (3-aminopyrrolidin-1-yl)-[6-(4-ethynyl-2-methylanilino)-7-fluoro-3H-benzimidazol-5-yl]methanone Traditional Name: (3-aminopyrrolidino)-[6-(4-ethynyl-2-methyl-anilino)-7-fluoro-3H-benzimidazol-5-yl]methanone Formula: C21H20FN5O MolecularWeight: 377.414803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#C)NC2=C(C3=C(C=C2C(=O)N4CCC(C4)N)NC=N3)F

Isomeric SMILES

CC1=C(C=CC(=C1)C#C)NC2=C(C3=C(C=C2C(=O)N4CCC(C4)N)NC=N3)F

InChI

InChI=1S/C21H20FN5O/c1-3-13-4-5-16(12(2)8-13)26-19-15(21(28)27-7-6-14(23)10-27)9-17-20(18(19)22)25-11-24-17/h1,4-5,8-9,11,14,26H,6-7,10,23H2,2H3,(H,24,25)