Vitas-M small molecule compound

2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide

Catalog ID
STK305843
SMILES O=C(C(Cn1nc(cc1C)[N+](=O)[O-])C)Nc1nc2c(s1)cc(cc2)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 C16H17N5O3S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3S/c1-9-4-5-12-13(6-9)25-16(17-12)18-15(22)10(2)8-20-11(3)7-14(19-20)21(23)24/h4-7,10H,8H2,1-3H3,(H,17,18,22)
InChIKey
WYIUBICEHXPELQ-UHFFFAOYSA-N
Synonyms
1005584-03-1
1005584031
2methylN(6methyl13benzothiazol2yl)3(5methyl3nitro1Hpyrazol1yl)propanamide
2methylN(6methyl13benzothiazol2yl)3(5methyl3nitropyrazol1yl)propanamide
CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)CN3C(=CC(=N3)(N+)(=O)(O))C
InChI=1SC16H17N5O3Sc19451213(69)2516(1712)1815(22)10(2)82011(3)714(1920)21(23)24h4710H8H213H3(H171822)
MFCD04046520
O=C(C(Cn1nc(cc1C)(N+)(=O)(O))C)Nc1nc2c(s1)cc(cc2)C
ZINC000002787778
ZINC000002787779

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Available files

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