AC1MXSWL

6-tert-butyl-2-[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Also Known As: Oprea1_244002|KS-00003S4L|SS-0756|AM-807/14957129|6-(tert-butyl)-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile|6-tert-butyl-2-[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile|6-tert-butyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile|6-(Tert-butyl)-2-((2-(3-methoxyphenyl)-2-oxoethyl)thio)-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile|6-tert-butyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile

Molecular Formula	C27H28N2O2S2
Molecular Weight	476.1592 g/mol
LogP	6.81638
Topological Polar Surface Area	62.98 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	476.1592
Monoisotopic Mass	476.1592
Heavy Atoms	33
Complexity	1204.0898

Chemical Identifiers

CAS Number	354556-52-8
SMILES	CC(C)(C)C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC(=CC=C3)OC)C#N)C4=CC=CS4