AC1LMISF
12-anilino-4,5-dimethyl-8-prop-2-enyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one
Also Known As: SR-01000264874-1|5-allyl-8-anilino-2,3-dimethylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one|5-allyl-2,3-dimethyl-8-(phenylamino)thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one|(8Z)-2,3-dimethyl-8-(phenylimino)-5-(prop-2-en-1-yl)-7,8-dihydrothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
| Molecular Formula | C18H17N5OS |
|---|---|
| Molecular Weight | 351.1154 g/mol |
| LogP | 3.65214 |
| Topological Polar Surface Area | 64.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.1154 |
| Monoisotopic Mass | 351.1154 |
| Heavy Atoms | 25 |
| Complexity | 1153.3496 |
Chemical Identifiers
| CAS Number | 501112-77-2 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C3=NN=C(N23)NC4=CC=CC=C4)CC=C)C |
Product Overview
AC1LMISF (CAS 501112-77-2), with molecular formula C18H17N5OS and molecular weight 351.1154 g/mol. IUPAC: 12-anilino-4,5-dimethyl-8-prop-2-enyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one.
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