Vitas-M small molecule compound
3-chloro-7-nitro-N-{3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}-1-benzothiophene-2-carboxamide
Catalog ID
STK294745
SMILES O=C(c1sc2c(c1Cl)cccc2[N+](=O)[O-])Nc1cccc(c1)c1nc2c(o1)ccc(c2)C(C)C
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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 C25H18ClN3O4S MW 491.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O4S/c1-13(2)14-9-10-20-18(12-14)28-25(33-20)15-5-3-6-16(11-15)27-24(30)23-21(26)17-7-4-8-19(29(31)32)22(17)34-23/h3-13H,1-2H3,(H,27,30)InChIKey
MZYGQOXVHHJAHU-UHFFFAOYSA-NSynonyms
3chloro7nitroN(3(5(propan2yl)13benzoxazol2yl)phenyl)1benzothiophene2carboxamide
3chloro7nitroN(3(5propan2yl13benzoxazol2yl)phenyl)1benzothiophene2carboxamide
CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=C(C5=C(S4)C(=CC=C5)(N+)(=O)(O))Cl
InChI=1SC25H18ClN3O4Sc113(2)149102018(1214)2825(3320)1553616(1115)2724(30)2321(26)1774819(29(31)32)22(17)3423h313H12H3(H2730)
MFCD07086475
O=C(c1sc2c(c1Cl)cccc2(N+)(=O)(O))Nc1cccc(c1)c1nc2c(o1)ccc(c2)C(C)C
ZINC000013946203
ZINC13946203
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