N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoro-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoro-4-methyl-2-quinazolinyl)-2-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoro-4-methylquinazolin-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(6-fluoro-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide Formula: C22H20FN5OS MolecularWeight: 421.490503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCCC3C(=O)NCC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCCC3C(=O)NCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20FN5OS/c1-13-15-11-14(23)8-9-16(15)27-22(25-13)28-10-4-6-18(28)21(29)24-12-20-26-17-5-2-3-7-19(17)30-20/h2-3,5,7-9,11,18H,4,6,10,12H2,1H3,(H,24,29)