Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-3,5-dimethoxybenzamide
Catalog ID
STK236793
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1cc(OC)cc(c1)OC
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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 C27H29N5O3S MW 503.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3S/c1-5-6-7-18-8-10-20(11-9-18)32-30-24-12-17(2)23(16-25(24)31-32)28-27(36)29-26(33)19-13-21(34-3)15-22(14-19)35-4/h8-16H,5-7H2,1-4H3,(H2,28,29,33,36)InChIKey
OVQPZSOURIQZNF-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC(=C4)OC)OC)C
InChI=1SC27H29N5O3Sc15671881020(11918)3230241217(2)23(1625(24)3132)2827(36)2926(33)191321(343)1522(1419)354h816H57H214H3(H228293336)
MFCD08107283
N((2(4butylphenyl)6methyl2Hbenzotriazol5yl)carbamothioyl)35dimethoxybenzamide
N((2(4butylphenyl)6methylbenzotriazol5yl)carbamothioyl)35dimethoxybenzamide
ZINC000009190363
ZINC09190363
ZINC9190363
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