Vitas-M small molecule compound
3-[(4-nitrobenzyl)sulfanyl]-5-[3-(propan-2-yloxy)phenyl]-4H-1,2,4-triazol-4-amine
Catalog ID
STL052620
SMILES CC(Oc1cccc(c1)c1nnc(n1N)SCc1ccc(cc1)[N+](=O)[O-])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 C18H19N5O3S MW 385.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O3S/c1-12(2)26-16-5-3-4-14(10-16)17-20-21-18(22(17)19)27-11-13-6-8-15(9-7-13)23(24)25/h3-10,12H,11,19H2,1-2H3InChIKey
PVTRCQUQFWYMTN-UHFFFAOYSA-NSynonyms
573938-32-63((4nitrobenzyl)sulfanyl)5(3(propan2yloxy)phenyl)4H124triazol4amine
3((4NITROPHENYL)METHYLSULFANYL)5(3PROPAN2YLOXYPHENYL)124TRIAZOL4AMINE
3(3isopropoxyphenyl)5((4nitrobenzyl)thio)4H124triazol4amine
5(3(METHYLETHOXY)PHENYL)3((4NITROPHENYL)METHYLTHIO)124TRIAZOLE4YLAMINE
573938326
CC(C)OC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)(N+)(=O)(O)
CC(Oc1cccc(c1)c1nnc(n1N)SCc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC18H19N5O3Sc112(2)261653414(1016)17202118(22(17)19)2711136815(9713)23(24)25h31012H1119H212H3
MFCD04020305
ZINC000004647431
ZINC04647431
ZINC4647431
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