Vitas-M small molecule compound
N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Catalog ID
STK304026
SMILES O=C(c1ccc(o1)Cn1ncc(c1)[N+](=O)[O-])Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(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 C24H26N6O5S MW 510.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O5S/c1-13-26-22-20(17-7-5-14(24(2,3)4)9-19(17)36-22)23(32)29(13)27-21(31)18-8-6-16(35-18)12-28-11-15(10-25-28)30(33)34/h6,8,10-11,14H,5,7,9,12H2,1-4H3,(H,27,31)InChIKey
YKAMZHQVELFHKO-UHFFFAOYSA-NSynonyms
1005707-12-91005707129
CC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1NC(=O)C4=CC=C(O4)CN5C=C(C=N5)(N+)(=O)(O)
InChI=1SC24H26N6O5Sc113262220(177514(24(23)4)919(17)3622)23(32)29(13)2721(31)188616(3518)12281115(102528)30(33)34h68101114H57912H214H3(H2731)
MFCD04042895
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)5((4nitro1Hpyrazol1yl)methyl)furan2carboxamide
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)5((4nitropyrazol1yl)methyl)furan2carboxamide
O=C(c1ccc(o1)Cn1ncc(c1)(N+)(=O)(O))Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C
ZINC000002779155
ZINC000002779156
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