Vitas-M small molecule compound
N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-(thiophen-2-yl)ethyl]-2-(1H-benzotriazol-1-yl)-N-benzylacetamide
Catalog ID
STL438816
SMILES O=C(N(C(c1cccs1)C(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1)Cn1nnc2c1cccc2
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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 C28H23N5O4S MW 525.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5O4S/c34-26(17-33-22-10-5-4-9-21(22)30-31-33)32(16-19-7-2-1-3-8-19)27(25-11-6-14-38-25)28(35)29-20-12-13-23-24(15-20)37-18-36-23/h1-15,27H,16-18H2,(H,29,35)InChIKey
VBMLCCITMQHOBR-UHFFFAOYSA-NSynonyms
2(2(1HBENZO(D)(123)TRIAZOL1YL)NBENZYLACETAMIDO)N(BENZO(D)(13)DIOXOL5YL)2(THIOPHEN2YL)ACETAMIDE
C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=CS3)N(CC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC28H23N5O4Sc3426(1733221054921(22)303133)32(16197213819)27(25116143825)28(35)292012132324(1520)37183623h11527H1618H2(H2935)
MFCD06239627
N(13BENZODIOXOL5YL)2((2(BENZOTRIAZOL1YL)ACETYL)BENZYLAMINO)2THIOPHEN2YLACETAMIDE
N(2(13benzodioxol5ylamino)2oxo1(thiophen2yl)ethyl)2(1Hbenzotriazol1yl)Nbenzylacetamide
ZINC000008712496
ZINC000008712497
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