Vitas-M small molecule compound
N-{(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK654099
SMILES COc1ccccc1N1CCN(CC1)C(=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 C26H27N5O3S MW 489.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3S/c1-18(25(33)30-15-13-29(14-16-30)21-7-3-4-8-22(21)34-2)27-24(32)19-9-10-20-23(17-19)35-26(28-20)31-11-5-6-12-31/h3-12,17-18H,13-16H2,1-2H3,(H,27,32)/t18-/m0/s1InChIKey
JEYMPULYFDNMAV-SFHVURJKSA-NSynonyms
1175967-42-6(S)N(1(4(2methoxyphenyl)piperazin1yl)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1175967426
CC(C(=O)N1CCN(CC1)C2=CC=CC=C2OC)NC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5
COc1ccccc1N1CCN(CC1)C(=O)(C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C
InChI=1SC26H27N5O3Sc118(25(33)30151329(141630)21734822(21)342)2724(32)199102023(1719)3526(2820)3111561231h3121718H1316H212H3(H2732)t18m0s1
MFCD18166923
N((2S)1(4(2methoxyphenyl)piperazin1yl)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(4(2methoxyphenyl)piperazin1yl)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000032096533
ZINC32096533
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