N-[1-[(2-fluoranyl-4-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Systemtic Name: N-[1-[(2-fluoranyl-4-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Openeye Name: N-[1-[(2-fluoro-4-methyl-phenyl)carbamoyl]-2-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide CAS Name: N-[1-(2-fluoro-4-methylanilino)-3-methyl-1-oxopentan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide IUPAC Name: N-[1-(2-fluoro-4-methylanilino)-3-methyl-1-oxopentan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Traditional Name: N-[1-[(2-fluoro-4-methyl-phenyl)carbamoyl]-2-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Formula: C23H28FN3O2 MolecularWeight: 397.485723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C=C(C=C1)C)F)NC(=O)C2CC3=CC=CC=C3CN2

Isomeric SMILES

CCC(C)C(C(=O)NC1=C(C=C(C=C1)C)F)NC(=O)C2CC3=CC=CC=C3CN2

InChI

InChI=1S/C23H28FN3O2/c1-4-15(3)21(23(29)26-19-10-9-14(2)11-18(19)24)27-22(28)20-12-16-7-5-6-8-17(16)13-25-20/h5-11,15,20-21,25H,4,12-13H2,1-3H3,(H,26,29)(H,27,28)