Vitas-M small molecule compound

N-{[2-(naphthalen-1-yl)-2H-benzotriazol-5-yl]carbamothioyl}-4-(propan-2-yloxy)benzamide

Catalog ID
STK095073
SMILES CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1cccc2c1cccc2)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 C27H23N5O2S MW 481.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O2S/c1-17(2)34-21-13-10-19(11-14-21)26(33)29-27(35)28-20-12-15-23-24(16-20)31-32(30-23)25-9-5-7-18-6-3-4-8-22(18)25/h3-17H,1-2H3,(H2,28,29,33,35)
InChIKey
SYSALKAHLPVYDG-UHFFFAOYSA-N
Synonyms
355430-89-6
(4(METHYLETHOXY)PHENYL)N(((2NAPHTHYL(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)CARBOXAMIDE
355430896
4isopropoxyN((2(naphthalen1yl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC5=CC=CC=C54
CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1cccc2c1cccc2)C
InChI=1SC27H23N5O2Sc117(2)3421131019(111421)26(33)2927(35)282012152324(1620)3132(3023)2595718634822(18)25h317H12H3(H228293335)
MFCD02603070
N((2(NAPHTHALEN1YL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4(PROPAN2YLOXY)BENZAMIDE
N((2NAPHTHALEN1YLBENZOTRIAZOL5YL)CARBAMOTHIOYL)4PROPAN2YLOXYBENZAMIDE
STK095073
ZINC000002231051
ZINC02231051
ZINC2231051

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.