Vitas-M small molecule compound
N-(2-methyl-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide
Catalog ID
STL403260
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCCCCc1s2)CCn1ccc(n1)[N+](=O)[O-]
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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 C19H22N6O4S MW 430.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O4S/c1-12-20-18-17(13-6-4-2-3-5-7-14(13)30-18)19(27)24(12)22-16(26)9-11-23-10-8-15(21-23)25(28)29/h8,10H,2-7,9,11H2,1H3,(H,22,26)InChIKey
JVFNCAWHMFIMLA-UHFFFAOYSA-NSynonyms
1005561-73-81005561738
CC1=NC2=C(C3=C(S2)CCCCCC3)C(=O)N1NC(=O)CCN4C=CC(=N4)(N+)(=O)(O)
InChI=1SC19H22N6O4Sc112201817(1364235714(13)3018)19(27)24(12)2216(26)9112310815(2123)25(28)29h810H27911H21H3(H2226)
MFCD04045367
N(2methyl4oxo5678910hexahydrocycloocta(23)thieno(24d)pyrimidin3yl)3(3nitropyrazol1yl)propanamide
N(2methyl4oxo5678910hexahydrocycloocta(45)thieno(23d)pyrimidin3(4H)yl)3(3nitro1Hpyrazol1yl)propanamide
O=C(Nn1c(C)nc2c(c1=O)c1CCCCCCc1s2)CCn1ccc(n1)(N+)(=O)(O)
ZINC000002780753
ZINC02780753
ZINC2780753
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