AC1N41H2
N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-5-nitro-3a,7a-dihydro-1-benzothiophene-2-carboxamide
Also Known As: F0737-0008|SR-01000008793-1|N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-5-nitro-3a,7a-dihydrobenzo[b]thiophene-2-carboxamide|N-{11-methyl-3,10-dithia-5,12-diazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,11-pentaen-4-yl}-5-nitro-3a,7a-dihydro-1-benzothiophene-2-carboxamide|N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-5-nitro-3a,7a-dihydro-1-benzothiophene-2-carboxamide|N-(7-methyl-1,6-dithia-3,8-diaza-as-indacen-2-yl)-5-nitro-1-thia-3a,7a-dihydro-2-indenecarboxamide
| Molecular Formula | C18H12N4O3S3 |
|---|---|
| Molecular Weight | 428.00714 g/mol |
| LogP | 4.49882 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.00714 |
| Monoisotopic Mass | 428.00714 |
| Heavy Atoms | 28 |
| Complexity | 1253.7153 |
Chemical Identifiers
| CAS Number | 476641-06-2 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=CC3=C2SC(=N3)NC(=O)C4=CC5C=C(C=CC5S4)[N+](=O)[O-] |
Product Overview
AC1N41H2 (CAS 476641-06-2), with molecular formula C18H12N4O3S3 and molecular weight 428.00714 g/mol. IUPAC: N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-5-nitro-3a,7a-dihydro-1-benzothiophene-2-carboxamide.