Vitas-M small molecule compound
7'-amino-2'-(ethylsulfanyl)-1-methyl-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Catalog ID
STK781287
SMILES CCSc1nc2NC(=C(C3(c2c(=O)[nH]1)c1ccccc1N(C3=O)C)C#N)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 C18H16N6O2S MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N6O2S/c1-3-27-17-22-14-12(15(25)23-17)18(10(8-19)13(20)21-14)9-6-4-5-7-11(9)24(2)16(18)26/h4-7H,3,20H2,1-2H3,(H2,21,22,23,25)InChIKey
SETMDACOSXCPQW-UHFFFAOYSA-NSynonyms
7amino2(ethylsulfanyl)1methyl24dioxo1248tetrahydro3Hspiro(indole35pyrido(23d)pyrimidine)6carbonitrile
7AMINO2ETHYLSULFANYL1METHYL24DIOXOSPIRO(18DIHYDROPYRIDO(23D)PYRIMIDINE53INDOLE)6CARBONITRILE
CCSC1=NC(=O)C2=C(N1)NC(=C(C23C4=CC=CC=C4N(C3=O)C)C#N)N
CCSc1nc2NC(=C(C3(c2c(=O)(nH)1)c1ccccc1N(C3=O)C)C#N)N
InChI=1SC18H16N6O2Sc132717221412(15(25)2317)18(10(819)13(20)2114)9645711(9)24(2)16(18)26h47H320H212H3(H221222325)
MFCD06014803
ZINC000004625220
ZINC000004625223
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