Vitas-M small molecule compound
N-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-nitrobenzamide
Catalog ID
STL113935
SMILES Cc1ccc(cc1)SCCNC(=O)c1ccc(cc1)[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 C16H16N2O3S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S/c1-12-2-8-15(9-3-12)22-11-10-17-16(19)13-4-6-14(7-5-13)18(20)21/h2-9H,10-11H2,1H3,(H,17,19)InChIKey
DQHMYHSWRZCCNJ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
Cc1ccc(cc1)SCCNC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H16N2O3Sc1122815(9312)2211101716(19)134614(7513)18(20)21h29H1011H21H3(H1719)
MFCD02918424
N(2((4methylphenyl)sulfanyl)ethyl)4nitrobenzamide
N(2(4METHYLPHENYL)SULFANYLETHYL)4NITROBENZAMIDE
ZINC000002983587
ZINC02983587
ZINC2983587
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