Vitas-M small molecule compound
N-{1-[(2E)-1,3-benzothiazol-2(3H)-ylideneamino]-1-oxopropan-2-yl}-4,5-dimethoxy-1H-indole-2-carboxamide
Catalog ID
STK643134
SMILES COc1c(OC)ccc2c1cc([nH]2)C(=O)NC(C(=O)/N=c\1/sc2c([nH]1)cccc2)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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-11(19(26)25-21-24-14-6-4-5-7-17(14)30-21)22-20(27)15-10-12-13(23-15)8-9-16(28-2)18(12)29-3/h4-11,23H,1-3H3,(H,22,27)(H,24,25,26)InChIKey
VXZMHRSRACOUHB-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=NC2=CC=CC=C2S1)NC(=O)C3=CC4=C(N3)C=CC(=C4OC)OC
COc1c(OC)ccc2c1cc((nH)2)C(=O)NC(C(=O)N=c1sc2c((nH)1)cccc2)C
InChI=1SC21H20N4O4Sc111(19(26)25212414645717(14)3021)2220(27)15101213(2315)8916(282)18(12)293h41123H13H3(H2227)(H242526)
MFCD18163204
N(1((2E)13benzothiazol2(3H)ylideneamino)1oxopropan2yl)45dimethoxy1Hindole2carboxamide
ZINC000012409780
ZINC000035686246
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