Vitas-M small molecule compound
methyl {5-amino-6-cyano-8-[(2,4-dimethylphenyl)carbamoyl]-7-(3-methoxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl}acetate
Catalog ID
STL440382
SMILES COC(=O)CC1SC2=C(C(=O)Nc3ccc(cc3C)C)C(C(=C(N2C1=O)N)C#N)c1cccc(c1)OC
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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 C27H26N4O5S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5S/c1-14-8-9-19(15(2)10-14)30-25(33)23-22(16-6-5-7-17(11-16)35-3)18(13-28)24(29)31-26(34)20(37-27(23)31)12-21(32)36-4/h5-11,20,22H,12,29H2,1-4H3,(H,30,33)InChIKey
BPIFOBUFVXHOCK-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2=C3N(C(=O)C(S3)CC(=O)OC)C(=C(C2C4=CC(=CC=C4)OC)C#N)N)C
InChI=1SC27H26N4O5Sc1148919(15(2)1014)3025(33)2322(1665717(1116)353)18(1328)24(29)3126(34)20(3727(23)31)1221(32)364h5112022H1229H214H3(H3033)
methyl(5amino6cyano8((24dimethylphenyl)carbamoyl)7(3methoxyphenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridin2yl)acetate
METHYL2(5AMINO6CYANO8((24DIMETHYLPHENYL)CARBAMOYL)7(3METHOXYPHENYL)3OXO7H(13)THIAZOLO(32A)PYRIDIN2YL)ACETATE
METHYL2(5AMINO6CYANO8(24DIMETHYLPHENYLCARBAMOYL)7(3METHOXYPHENYL)3OXO37DIHYDRO2HTHIAZOLO(32A)PYRIDIN2YL)ACETATE
MFCD06242208
ZINC000003770106
ZINC000003770109
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