Vitas-M small molecule compound
4-nitro-N-[(2Z)-5-[2-(piperidin-1-yl)ethyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Catalog ID
STL055448
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])/N=c\1/[nH]nc(s1)CCN1CCCCC1
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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 C16H19N5O3S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O3S/c22-15(12-4-6-13(7-5-12)21(23)24)17-16-19-18-14(25-16)8-11-20-9-2-1-3-10-20/h4-7H,1-3,8-11H2,(H,17,19,22)InChIKey
BJYRGAPQGYVPCY-UHFFFAOYSA-NSynonyms
714244-68-54nitroN((2Z)5(2(piperidin1yl)ethyl)134thiadiazol2(3H)ylidene)benzamide
4NITRON(5(2PIPERIDIN1YLETHYL)134THIADIAZOL2YL)BENZAMIDE
714244685
C1CCN(CC1)CCC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H19N5O3Sc2215(124613(7512)21(23)24)1716191814(2516)8112092131020h47H13811H2(H171922)
MFCD05730897
O=C(c1ccc(cc1)(N+)(=O)(O))N=c1(nH)nc(s1)CCN1CCCCC1
ZINC000001876878
ZINC01876878
ZINC1876878
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