Vitas-M small molecule compound

2-[2'-amino-3'-cyano-1'-(dimethylamino)-7',7'-dimethyl-2,5'-dioxo-5',6',7',8'-tetrahydro-1'H-spiro[indole-3,4'-quinolin]-1(2H)-yl]-N-(3-methoxyphenyl)acetamide

Catalog ID
STK688739
SMILES COc1cccc(c1)NC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)N(C1=C2C(=O)CC(C1)(C)C)N(C)C)C#N

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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 C30H32N6O4 MW 540.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N6O4/c1-29(2)14-23-26(24(37)15-29)30(21(16-31)27(32)36(23)34(3)4)20-11-6-7-12-22(20)35(28(30)39)17-25(38)33-18-9-8-10-19(13-18)40-5/h6-13H,14-15,17,32H2,1-5H3,(H,33,38)
InChIKey
IMYWHKMMEJZATI-UHFFFAOYSA-N
Synonyms

2(2amino3cyano1(dimethylamino)77dimethyl25dioxo5678tetrahydro1Hspiro(indole34quinolin)1(2H)yl)N(3methoxyphenyl)acetamide
2(2AMINO3CYANO1(DIMETHYLAMINO)77DIMETHYL25DIOXOSPIRO(68DIHYDROQUINOLINE43INDOLE)1YL)N(3METHOXYPHENYL)ACETAMIDE
CC1(CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC(=O)NC5=CC(=CC=C5)OC)C(=C(N2N(C)C)N)C#N)C
InChI=1SC30H32N6O4c129(2)142326(24(37)1529)30(21(1631)27(32)36(23)34(3)4)2011671222(20)35(28(30)39)1725(38)3318981019(1318)405h613H14151732H215H3(H3338)
MFCD07658526
ZINC000098009042
ZINC000098009043

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Available files

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