Vitas-M small molecule compound
2-amino-4-[4-(azepan-1-ylmethyl)thiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK687303
SMILES N#CC1=C(N)OC2=C(C1c1scc(c1)CN1CCCCCC1)C(=O)CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H25N3O2S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S/c22-11-15-19(20-16(25)6-5-7-17(20)26-21(15)23)18-10-14(13-27-18)12-24-8-3-1-2-4-9-24/h10,13,19H,1-9,12,23H2InChIKey
JPSLYJHUBCUHPR-UHFFFAOYSA-NSynonyms
2amino4(4(azepan1ylmethyl)thiophen2yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(4(azepan1ylmethyl)thiophen2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
C1CCCN(CC1)CC2=CSC(=C2)C3C(=C(OC4=C3C(=O)CCC4)N)C#N
InChI=1SC21H25N3O2Sc22111519(2016(25)65717(20)2621(15)23)181014(132718)122483124924h101319H191223H2
MFCD06618271
ZINC000004751291
ZINC000004751292
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