Vitas-M small molecule compound
N-{3-[(2E)-1,3-benzothiazol-2(3H)-ylideneamino]-3-oxopropyl}-4,7-dimethoxy-1H-indole-2-carboxamide
Catalog ID
STK636094
SMILES COc1ccc(c2c1[nH]c(c2)C(=O)NCCC(=O)/N=c/1\[nH]c2c(s1)cccc2)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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-28-15-7-8-16(29-2)19-12(15)11-14(23-19)20(27)22-10-9-18(26)25-21-24-13-5-3-4-6-17(13)30-21/h3-8,11,23H,9-10H2,1-2H3,(H,22,27)(H,24,25,26)InChIKey
MPSVUKRWJGHEEV-UHFFFAOYSA-NSynonyms
1010878-40-61010878406
COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NCCC(=O)NC3=NC4=CC=CC=C4S3
COc1ccc(c2c1(nH)c(c2)C(=O)NCCC(=O)N=c1(nH)c2c(s1)cccc2)OC
InChI=1SC21H20N4O4Sc128157816(292)1912(15)1114(2319)20(27)2210918(26)25212413534617(13)3021h381123H910H212H3(H2227)(H242526)
MFCD18160963
N(3((2E)13benzothiazol2(3H)ylideneamino)3oxopropyl)47dimethoxy1Hindole2carboxamide
ZINC000012408260
ZINC12408260
ZINC49937914
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