Vitas-M small molecule compound

8-ethyl-5-oxo-2-(4-{[(4-propoxyphenyl)carbonyl]carbamothioyl}piperazin-1-yl)-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid

Catalog ID
STL232148
SMILES CCCOc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)O

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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 C25H28N6O5S MW 524.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O5S/c1-3-13-36-17-7-5-16(6-8-17)22(33)28-25(37)31-11-9-30(10-12-31)24-26-14-18-20(32)19(23(34)35)15-29(4-2)21(18)27-24/h5-8,14-15H,3-4,9-13H2,1-2H3,(H,34,35)(H,28,33,37)
InChIKey
ZQMKQDPRPVJESC-UHFFFAOYSA-N
Synonyms
400828-73-1
400828731
8ETHYL5KETO2(4((4PROPOXYBENZOYL)THIOCARBAMOYL)PIPERAZINO)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
8ETHYL5OXIDANYLIDENE2(4((4PROPOXYPHENYL)CARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
8ethyl5oxo2(4(((4propoxyphenyl)carbonyl)carbamothioyl)piperazin1yl)58dihydropyrido(23d)pyrimidine6carboxylicacid
8ETHYL5OXO2(4(((OXO(4PROPOXYPHENYL)METHYL)AMINO)SULFANYLIDENEMETHYL)1PIPERAZINYL)6PYRIDO(23D)PYRIMIDINECARBOXYLICACID
8ethyl5oxo2(4((4propoxybenzoyl)carbamothioyl)piperazin1yl)58dihydropyrido(23d)pyrimidine6carboxylicacid
8ETHYL5OXO2(4((4PROPOXYBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
CCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=NC=C4C(=O)C(=CN(C4=N3)CC)C(=O)O
InChI=1SC25H28N6O5Sc131336177516(6817)22(33)2825(37)3111930(101231)2426141820(32)19(23(34)35)1529(42)21(18)2724h581415H34913H212H3(H3435)(H283337)
MFCD01994199
ZINC000013576797
ZINC13576797

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Available files

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