2-[3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-[3-(4-methyl-1-piperidyl)propyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-[3-(4-methyl-1-piperidinyl)propyl]-4-oxo-2-quinazolinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[4-keto-3-[3-(4-methylpiperidino)propyl]quinazolin-2-yl]thio]acetamide Formula: C26H32N4O2S MolecularWeight: 464.62288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-20-12-16-29(17-13-20)14-7-15-30-25(32)22-10-5-6-11-23(22)28-26(30)33-19-24(31)27-18-21-8-3-2-4-9-21/h2-6,8-11,20H,7,12-19H2,1H3,(H,27,31)