Vitas-M small molecule compound
2-({3-chloro-2-[(4-nitrophenyl)sulfanyl]propyl}sulfanyl)quinazolin-4(3H)-one
Catalog ID
STL079730
SMILES ClCC(Sc1ccc(cc1)[N+](=O)[O-])CSc1nc2ccccc2c(=O)[nH]1
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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 C17H14ClN3O3S2 MW 407.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O3S2/c18-9-13(26-12-7-5-11(6-8-12)21(23)24)10-25-17-19-15-4-2-1-3-14(15)16(22)20-17/h1-8,13H,9-10H2,(H,19,20,22)InChIKey
JMZMNQZHOQKIBS-UHFFFAOYSA-NSynonyms
2((3chloro2((4nitrophenyl)sulfanyl)propyl)sulfanyl)quinazolin4(3H)one
2(3chloro2(4nitrophenyl)sulfanylpropyl)sulfanyl1Hquinazolin4one
C1=CC=C2C(=C1)C(=O)N=C(N2)SCC(CCl)SC3=CC=C(C=C3)(N+)(=O)(O)
ClCC(Sc1ccc(cc1)(N+)(=O)(O))CSc1nc2ccccc2c(=O)(nH)1
InChI=1SC17H14ClN3O3S2c18913(26127511(6812)21(23)24)1025171915421314(15)16(22)2017h1813H910H2(H192022)
MFCD18200596
ZINC000057505484
ZINC000057505488
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