Vitas-M small molecule compound
2-amino-7,7-dimethyl-1-(4-methylphenyl)-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK779873
SMILES N#CC1=C(N)N(c2ccc(cc2)C)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 C28H32N4O2S MW 488.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O2S/c1-18-4-6-20(7-5-18)32-22-13-28(2,3)14-23(33)26(22)25(21(15-29)27(32)30)24-12-19(17-35-24)16-31-8-10-34-11-9-31/h4-7,12,17,25H,8-11,13-14,16,30H2,1-3H3InChIKey
GHLKXUWMZBGJSG-UHFFFAOYSA-NSynonyms
2amino77dimethyl1(4methylphenyl)4(4(morpholin4ylmethyl)thiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL1(4METHYLPHENYL)4(4(MORPHOLIN4YLMETHYL)THIOPHEN2YL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=CC(=CS4)CN5CCOCC5)C(=O)CC(C3)(C)C
InChI=1SC28H32N4O2Sc1184620(7518)32221328(23)1423(33)26(22)25(21(1529)27(32)30)241219(173524)16318103411931h47121725H81113141630H213H3
MFCD05859409
ZINC000012447789
ZINC000012447790
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