Vitas-M small molecule compound
2-amino-7,7-dimethyl-4-(9-methyl-9H-carbazol-3-yl)-5-oxo-1-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK685038
SMILES N#CC1=C(N)N(c2nnc(s2)SC(C)C)C2=C(C1c1ccc3c(c1)c1ccccc1n3C)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 C30H30N6OS2 MW 554.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6OS2/c1-16(2)38-29-34-33-28(39-29)36-23-13-30(3,4)14-24(37)26(23)25(20(15-31)27(36)32)17-10-11-22-19(12-17)18-8-6-7-9-21(18)35(22)5/h6-12,16,25H,13-14,32H2,1-5H3InChIKey
MHCOIMQNNCLGPD-UHFFFAOYSA-NSynonyms
2amino77dimethyl4(9methyl9Hcarbazol3yl)5oxo1(5(propan2ylsulfanyl)134thiadiazol2yl)145678hexahydroquinoline3carbonitrile
2AMINO77DIMETHYL4(9METHYLCARBAZOL3YL)5OXO1(5PROPAN2YLSULFANYL134THIADIAZOL2YL)68DIHYDRO4HQUINOLINE3CARBONITRILE
CC(C)SC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC5=C(C=C4)N(C6=CC=CC=C65)C)C(=O)CC(C3)(C)C
InChI=1SC30H30N6OS2c116(2)3829343328(3929)36231330(34)1424(37)26(23)25(20(1531)27(36)32)1710112219(1217)18867921(18)35(22)5h6121625H131432H215H3
MFCD05856995
ZINC000098007268
ZINC000098007269
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