Vitas-M small molecule compound
4-(6-nitro-4-oxoquinazolin-3(4H)-yl)-N-[(2Z)-3,4,5,6-tetrahydro-2H-cyclopenta[d][1,3]thiazol-2-ylidene]butanamide
Catalog ID
STL410249
SMILES O=C(/N=c\1/[nH]c2c(s1)CCC2)CCCn1cnc2c(c1=O)cc(cc2)[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 C18H17N5O4S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O4S/c24-16(21-18-20-14-3-1-4-15(14)28-18)5-2-8-22-10-19-13-7-6-11(23(26)27)9-12(13)17(22)25/h6-7,9-10H,1-5,8H2,(H,20,21,24)InChIKey
LWYFNMFMAIIHDI-UHFFFAOYSA-NSynonyms
1574400-06-81574400068
4(6nitro4oxoquinazolin3(4H)yl)N((2Z)3456tetrahydro2Hcyclopenta(d)(13)thiazol2ylidene)butanamide
C1CC2=C(C1)SC(=N2)NC(=O)CCCN3C=NC4=C(C3=O)C=C(C=C4)(N+)(=O)(O)
InChI=1SC18H17N5O4Sc2416(2118201431415(14)2818)528221019137611(23(26)27)912(13)17(22)25h67910H158H2(H202124)
MFCD30706112
N(56dihydro4Hcyclopenta(d)(13)thiazol2yl)4(6nitro4oxoquinazolin3yl)butanamide
O=C(N=c1(nH)c2c(s1)CCC2)CCCn1cnc2c(c1=O)cc(cc2)(N+)(=O)(O)
ZINC000096223726
ZINC96223726
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