Vitas-M small molecule compound
N-{1-[(2E)-1,3-benzothiazol-2(3H)-ylideneamino]-1-oxopropan-2-yl}-5-methoxy-1-methyl-1H-indole-2-carboxamide
Catalog ID
STK638591
SMILES COc1ccc2c(c1)cc(n2C)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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-12(19(26)24-21-23-15-6-4-5-7-18(15)29-21)22-20(27)17-11-13-10-14(28-3)8-9-16(13)25(17)2/h4-12H,1-3H3,(H,22,27)(H,23,24,26)InChIKey
LLWMYOVDPUNQMS-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=NC2=CC=CC=C2S1)NC(=O)C3=CC4=C(N3C)C=CC(=C4)OC
COc1ccc2c(c1)cc(n2C)C(=O)NC(C(=O)N=c1sc2c((nH)1)cccc2)C
InChI=1SC21H20N4O3Sc112(19(26)24212315645718(15)2921)2220(27)1711131014(283)8916(13)25(17)2h412H13H3(H2227)(H232426)
MFCD18161734
N(1((2E)13benzothiazol2(3H)ylideneamino)1oxopropan2yl)5methoxy1methyl1Hindole2carboxamide
N(1(13benzothiazol2ylamino)1oxopropan2yl)5methoxy1methylindole2carboxamide
ZINC000013733525
ZINC000036575598
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