Vitas-M small molecule compound

N-(2,1,3-benzothiadiazol-4-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide

Catalog ID
STK193221
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)Nc1cccc2c1nsn2

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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 C17H15N5O3S MW 369.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O3S/c23-17(18-12-4-3-5-13-16(12)20-26-19-13)11-6-7-14(15(10-11)22(24)25)21-8-1-2-9-21/h3-7,10H,1-2,8-9H2,(H,18,23)
InChIKey
IILYGEQSLZORRX-UHFFFAOYSA-N
Synonyms

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC4=NSN=C43)(N+)(=O)(O)
InChI=1SC17H15N5O3Sc2317(18124351316(12)20261913)116714(15(1011)22(24)25)21812921h3710H1289H2(H1823)
MFCD07174609
N(213BENZOTHIADIAZOL4YL)3NITRO4(PYRROLIDIN1YL)BENZAMIDE
N(213BENZOTHIADIAZOL4YL)3NITRO4PYRROLIDIN1YLBENZAMIDE
O=C(c1ccc(c(c1)(N+)(=O)(O))N1CCCC1)Nc1cccc2c1nsn2
ZINC000004712101
ZINC04712101
ZINC4712101

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Available files

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