Vitas-M small molecule compound

propan-2-yl 5-carbamoyl-2-({[4-(3-methoxybenzyl)piperazin-1-yl]acetyl}amino)-4-methylthiophene-3-carboxylate

Catalog ID
STK460434
SMILES COc1cccc(c1)CN1CCN(CC1)CC(=O)Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N

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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 C24H32N4O5S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N4O5S/c1-15(2)33-24(31)20-16(3)21(22(25)30)34-23(20)26-19(29)14-28-10-8-27(9-11-28)13-17-6-5-7-18(12-17)32-4/h5-7,12,15H,8-11,13-14H2,1-4H3,(H2,25,30)(H,26,29)
InChIKey
GZQBHUJONTUGLE-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)OC)C(=O)N
InChI=1SC24H32N4O5Sc115(2)3324(31)2016(3)21(22(25)30)3423(20)2619(29)142810827(91128)131765718(1217)324h571215H8111314H214H3(H22530)(H2629)
METHYLETHYL5CARBAMOYL2(2(4((3METHOXYPHENYL)METHYL)PIPERAZINYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD06172339
propan2yl5carbamoyl2(((4(3methoxybenzyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
propan2yl5carbamoyl2((2(4((3methoxyphenyl)methyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
ZINC000020294979
ZINC20294979

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Available files

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