Vitas-M small molecule compound
3,4,5-triethoxy-N-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK163247
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)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 C28H29N3O4S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S2/c1-5-33-22-15-19(16-23(34-6-2)25(22)35-7-3)26(32)31-28(36)29-20-11-9-18(10-12-20)27-30-21-13-8-17(4)14-24(21)37-27/h8-16H,5-7H2,1-4H3,(H2,29,31,32,36)InChIKey
IBZQGANWONDWNC-UHFFFAOYSA-NSynonyms
345TRIETHOXYN((4(6METHYL13BENZOTHIAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C
InChI=1SC28H29N3O4S2c1533221519(1623(3462)25(22)3573)26(32)3128(36)292011918(101220)27302113817(4)1424(21)3727h816H57H214H3(H229313236)
MFCD02603090
N(((4(6METHYLBENZOTHIAZOL2YL)PHENYL)AMINO)THIOXOMETHYL)(345TRIETHOXYPHENYL)CARBOXAMIDE
ZINC000002052360
ZINC2052360
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