Vitas-M small molecule compound
2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK779916
SMILES N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CC(C2)(C)C
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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 C27H29ClN4O2S MW 509.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClN4O2S/c1-27(2)12-21-25(22(33)13-27)24(23-11-17(16-35-23)15-31-7-9-34-10-8-31)20(14-29)26(30)32(21)19-5-3-18(28)4-6-19/h3-6,11,16,24H,7-10,12-13,15,30H2,1-2H3InChIKey
TUHPXFPOAAELQW-UHFFFAOYSA-NSynonyms
2amino1(4chlorophenyl)77dimethyl4(4(morpholin4ylmethyl)thiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(4CHLOROPHENYL)77DIMETHYL4(4(MORPHOLIN4YLMETHYL)THIOPHEN2YL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)Cl)N)C#N)C4=CC(=CS4)CN5CCOCC5)C(=O)C1)C
InChI=1SC27H29ClN4O2Sc127(2)122125(22(33)1327)24(231117(163523)1531793410831)20(1429)26(30)32(21)195318(28)4619h36111624H71012131530H212H3
MFCD05859490
ZINC000012402304
ZINC000012402305
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