Vitas-M small molecule compound
N-{(2S)-1-[(2-methoxybenzyl)amino]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK652978
SMILES COc1ccccc1CNC(=O)[C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)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 C23H22N4O3S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S/c1-15(21(28)24-14-17-7-3-4-8-19(17)30-2)25-22(29)16-9-10-18-20(13-16)31-23(26-18)27-11-5-6-12-27/h3-13,15H,14H2,1-2H3,(H,24,28)(H,25,29)/t15-/m0/s1InChIKey
CCIJGHCVEGHCOJ-HNNXBMFYSA-NSynonyms
1176657-74-1(S)N(1((2methoxybenzyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1176657741
CC(C(=O)NCC1=CC=CC=C1OC)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
COc1ccccc1CNC(=O)(C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C
InChI=1SC23H22N4O3Sc115(21(28)241417734819(17)302)2522(29)169101820(1316)3123(2618)2711561227h31315H14H212H3(H2428)(H2529)t15m0s1
MFCD18166519
N((2S)1((2methoxybenzyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1((2methoxyphenyl)methylamino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000032092261
ZINC32092261
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