AC1LJZK2

N-(5-methyl-1,2-oxazol-3-yl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide

Also Known As: Oprea1_752518|F1174-1413|AF-399/40806200|SR-01000505006-1|2-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide|N-(5-methyl-1,2-oxazol-3-yl)-2-{[12-oxo-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}acetamide|2-[(3-ALLYL-4-OXO-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]-N-(5-METHYL-3-ISOXAZOLYL)ACETAMIDE|N-(5-methyl-1,2-oxazol-3-yl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide|N-(5-methyl-3-isoxazolyl){11-allyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0(2),]dodeca-1(8),2(6),9-trien-10-ylthio}acetamide

Molecular Formula	C18H18N4O3S2
Molecular Weight	402.08203 g/mol
LogP	3.15992
Topological Polar Surface Area	90.02 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	402.08203
Monoisotopic Mass	402.08203
Heavy Atoms	27
Complexity	1096.1508

Chemical Identifiers

CAS Number	379243-07-9
SMILES	CC1=CC(=NO1)NC(=O)CSC2=NC3=C(C4=C(S3)CCC4)C(=O)N2CC=C