Vitas-M small molecule compound
(4-methylpiperazin-1-yl)[5-(3-nitrophenyl)furan-2-yl]methanethione
Catalog ID
STL053931
SMILES CN1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)[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 C16H17N3O3S MW 331.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S/c1-17-7-9-18(10-8-17)16(23)15-6-5-14(22-15)12-3-2-4-13(11-12)19(20)21/h2-6,11H,7-10H2,1H3InChIKey
JNCYVQMJFZNWNC-UHFFFAOYSA-NSynonyms
714927-30-7(4methylpiperazin1yl)(5(3nitrophenyl)furan2yl)methanethione
714927307
CN1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
CN1CCN(CC1)C(=S)C2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC16H17N3O3Sc1177918(10817)16(23)156514(2215)1232413(1112)19(20)21h2611H710H21H3
MFCD04007375
ZINC000005529543
ZINC5529543
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