N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(7-mesyl-4-methyl-quinazolin-2-yl)isonipecotamide Formula: C24H27ClN4O3S MolecularWeight: 487.01418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NC(C)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N[C@@H](C)C4=CC=CC=C4Cl

InChI

InChI=1S/C24H27ClN4O3S/c1-15(19-6-4-5-7-21(19)25)26-23(30)17-10-12-29(13-11-17)24-27-16(2)20-9-8-18(33(3,31)32)14-22(20)28-24/h4-9,14-15,17H,10-13H2,1-3H3,(H,26,30)/t15-/m0/s1