Vitas-M small molecule compound
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(2-methyl-5-nitrophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL174375
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CC(C2)c1ccccc1)c1cc(ccc1C)[N+](=O)[O-]
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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 C31H30N4O3S MW 538.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3S/c1-18-10-11-21(35(37)38)16-23(18)34-24-14-20(19-8-6-5-7-9-19)15-25(36)29(24)28(22(17-32)30(34)33)26-12-13-27(39-26)31(2,3)4/h5-13,16,20,28H,14-15,33H2,1-4H3InChIKey
BXGVXKSQRFQERQ-UHFFFAOYSA-NSynonyms
444934-85-42amino4(5tertbutylthiophen2yl)1(2methyl5nitrophenyl)5oxo7phenyl145678hexahydroquinoline3carbonitrile
2amino4(5tertbutylthiophen2yl)1(2methyl5nitrophenyl)5oxo7phenyl4678tetrahydroquinoline3carbonitrile
444934854
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C3=C(C(C(=C2N)C#N)C4=CC=C(S4)C(C)(C)C)C(=O)CC(C3)C5=CC=CC=C5
InChI=1SC31H30N4O3Sc118101121(35(37)38)1623(18)34241420(198657919)1525(36)29(24)28(22(1732)30(34)33)26121327(3926)31(23)4h513162028H141533H214H3
MFCD02606156
N#CC1=C(N)N(C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CC(C2)c1ccccc1)c1cc(ccc1C)(N+)(=O)(O)
ZINC000002090983
ZINC000002090990
Check stock
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