ChemDiv1_028696

prop-2-enyl 5-cyano-2-methyl-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate

Also Known As: ChemDiv1_028696|Oprea1_034964|Oprea1_067252|HMS668I08|SR-01000484813-1|allyl 5-cyano-6-((2-(mesitylamino)-2-oxoethyl)thio)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate|PROP-2-EN-1-YL 5-CYANO-2-METHYL-4-(THIOPHEN-2-YL)-6-({[(2,4,6-TRIMETHYLPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE|prop-2-en-1-yl 5-cyano-2-methyl-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate|prop-2-enyl 5-cyano-2-methyl-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate

Molecular Formula	C26H27N3O3S2
Molecular Weight	493.14938 g/mol
LogP	5.47044
Topological Polar Surface Area	91.22 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	493.14938
Monoisotopic Mass	493.14938
Heavy Atoms	34
Complexity	1197.4059

Chemical Identifiers

CAS Number	384357-39-5
SMILES	CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CS3)C#N)C