Vitas-M small molecule compound

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

Catalog ID
STK458771
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N)CN1CCC(CC1)Cc1ccccc1

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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 C24H31N3O4S MW 457.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O4S/c1-15(2)31-24(30)20-16(3)21(22(25)29)32-23(20)26-19(28)14-27-11-9-18(10-12-27)13-17-7-5-4-6-8-17/h4-8,15,18H,9-14H2,1-3H3,(H2,25,29)(H,26,28)
InChIKey
BTDLVRCGAAEJLQ-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN2CCC(CC2)CC3=CC=CC=C3)C(=O)N
InChI=1SC24H31N3O4Sc115(2)3124(30)2016(3)21(22(25)29)3223(20)2619(28)142711918(101227)13177546817h481518H914H213H3(H22529)(H2628)
MFCD06195018
propan2yl2(((4benzylpiperidin1yl)acetyl)amino)5carbamoyl4methylthiophene3carboxylate
propan2yl2((2(4benzylpiperidin1yl)acetyl)amino)5carbamoyl4methylthiophene3carboxylate
ZINC000020294920
ZINC20294920

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.