AC1LT8EM

propan-2-yl 2-[[(E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Also Known As: F1589-1170|(E)-isopropyl 2-(2-cyano-3-(5-methylthiophen-2-yl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|propan-2-yl 2-[(2E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|propan-2-yl 2-[[(E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|isopropyl 2-[(E)-1-cyano-2-(5-methyl-2-thienyl)ethenylcarbonylamino]-1-thia-4,5,6,7-tetrahydro-3-indenecarboxylate|methylethyl 2-[(2E)-2-cyano-3-(5-methyl(2-thienyl))prop-2-enoylamino]-4,5,6,7- tetrahydrobenzo[b]thiophene-3-carboxylate|propan-2-yl 2-{[(2E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Molecular Formula	C21H22N2O3S2
Molecular Weight	414.10718 g/mol
LogP	5.1077
Topological Polar Surface Area	79.19 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	414.10718
Monoisotopic Mass	414.10718
Heavy Atoms	28
Complexity	976.4281

Chemical Identifiers

CAS Number	488137-66-2
SMILES	CC1=CC=C(S1)/C=C(\C#N)/C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC(C)C