2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[(6-methoxy-2-phenyl-4-quinazolinyl)thio]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-(6-methoxy-2-phenylquinazolin-4-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[(6-methoxy-2-phenyl-quinazolin-4-yl)thio]-1-(4-methylpiperidino)ethanone Formula: C23H25N3O2S MolecularWeight: 407.5285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC(=NC3=C2C=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC(=NC3=C2C=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-16-10-12-26(13-11-16)21(27)15-29-23-19-14-18(28-2)8-9-20(19)24-22(25-23)17-6-4-3-5-7-17/h3-9,14,16H,10-13,15H2,1-2H3