Vitas-M small molecule compound

ethyl 3,5-dimethyl-4-{[(2E)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamoyl}-1H-pyrrole-2-carboxylate

Catalog ID
STL315998
SMILES CCOC(=O)c1[nH]c(c(c1C)C(=O)/N=c/1\[nH]nc(s1)C(C)C)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 C15H20N4O3S MW 336.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N4O3S/c1-6-22-14(21)11-8(4)10(9(5)16-11)12(20)17-15-19-18-13(23-15)7(2)3/h7,16H,6H2,1-5H3,(H,17,19,20)
InChIKey
NCKXPHYAOMTNJQ-UHFFFAOYSA-N
Synonyms
1574309-74-2
1574309742
CCOC(=O)c1(nH)c(c(c1C)C(=O)N=c1(nH)nc(s1)C(C)C)C
CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=NN=C(S2)C(C)C)C
ethyl35dimethyl4(((2E)5(propan2yl)134thiadiazol2(3H)ylidene)carbamoyl)1Hpyrrole2carboxylate
ethyl35dimethyl4((5propan2yl134thiadiazol2yl)carbamoyl)1Hpyrrole2carboxylate
InChI=1SC15H20N4O3Sc162214(21)118(4)10(9(5)1611)12(20)1715191813(2315)7(2)3h716H6H215H3(H171920)
MFCD28027565
ZINC000095477437
ZINC95477437

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Available files

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