Vitas-M small molecule compound
7-nitro-2-(thiophen-2-yl)-3-{[(E)-thiophen-2-ylmethylidene]amino}-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK764918
SMILES O=C1N(/N=C/c2cccs2)C(Nc2c1ccc(c2)[N+](=O)[O-])c1cccs1
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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 C17H12N4O3S2 MW 384.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O3S2/c22-17-13-6-5-11(21(23)24)9-14(13)19-16(15-4-2-8-26-15)20(17)18-10-12-3-1-7-25-12/h1-10,16,19H/b18-10+InChIKey
OOYVVBRNFLBRKP-VCHYOVAHSA-NSynonyms
7nitro2(thiophen2yl)3(((E)thiophen2ylmethylidene)amino)23dihydroquinazolin4(1H)one
7nitro2thiophen2yl3((E)thiophen2ylmethylideneamino)12dihydroquinazolin4one
C1=CSC(=C1)C=NN2C(NC3=C(C2=O)C=CC(=C3)(N+)(=O)(O))C4=CC=CS4
InChI=1SC17H12N4O3S2c2217136511(21(23)24)914(13)1916(154282615)20(17)1810123172512h1101619Hb1810+
MFCD02933344
O=C1N(N=Cc2cccs2)C(Nc2c1ccc(c2)(N+)(=O)(O))c1cccs1
ZINC000000720620
ZINC000000720623
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