Vitas-M small molecule compound
3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Catalog ID
STK304191
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCCCc1s2)CCn1nc(c(c1C)[N+](=O)[O-])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 C19H22N6O4S MW 430.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O4S/c1-10-17(25(28)29)11(2)23(21-10)9-8-15(26)22-24-12(3)20-18-16(19(24)27)13-6-4-5-7-14(13)30-18/h4-9H2,1-3H3,(H,22,26)InChIKey
XCLCQYSMKSLXKT-UHFFFAOYSA-NSynonyms
1005561-27-21005561272
3(35dimethyl4nitro1Hpyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)propanamide
3(35dimethyl4nitropyrazol1yl)N(2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)propanamide
CC1=C(C(=NN1CCC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CCCC4)C)C)(N+)(=O)(O)
InChI=1SC19H22N6O4Sc11017(25(28)29)11(2)23(2110)9815(26)222412(3)201816(19(24)27)13645714(13)3018h49H213H3(H2226)
MFCD04044594
O=C(Nn1c(C)nc2c(c1=O)c1CCCCc1s2)CCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000002780294
ZINC02780294
ZINC2780294
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