Vitas-M small molecule compound

propan-2-yl 5-methyl-2-[({2-[4-(2-methylpropyl)phenyl]quinolin-4-yl}carbonyl)amino]-4-[4-(propan-2-yl)phenyl]thiophene-3-carboxylate

Catalog ID
STK422499
SMILES CC(OC(=O)c1c(sc(c1c1ccc(cc1)C(C)C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)CC(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 C38H40N2O3S MW 604.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H40N2O3S/c1-22(2)20-26-12-14-28(15-13-26)33-21-31(30-10-8-9-11-32(30)39-33)36(41)40-37-35(38(42)43-24(5)6)34(25(7)44-37)29-18-16-27(17-19-29)23(3)4/h8-19,21-24H,20H2,1-7H3,(H,40,41)
InChIKey
KFCQOVKWBARPET-UHFFFAOYSA-N
Synonyms

CC1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C(=O)OC(C)C)C5=CC=C(C=C5)C(C)C
InChI=1SC38H40N2O3Sc122(2)2026121428(151326)332131(3010891132(30)3933)36(41)403735(38(42)4324(5)6)34(25(7)4437)29181627(171929)23(3)4h8192124H20H217H3(H4041)
ISOPROPYL2(((2(4ISOBUTYLPHENYL)QUINOLIN4YL)CARBONYL)AMINO)4(4ISOPROPYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYLETHYL5METHYL4(4(METHYLETHYL)PHENYL)2((2(4(2METHYLPROPYL)PHENYL)(4QUINOLYL))CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02244492
propan2yl5methyl2(((2(4(2methylpropyl)phenyl)quinolin4yl)carbonyl)amino)4(4(propan2yl)phenyl)thiophene3carboxylate
PROPAN2YL5METHYL2((2(4(2METHYLPROPYL)PHENYL)QUINOLINE4CARBONYL)AMINO)4(4PROPAN2YLPHENYL)THIOPHENE3CARBOXYLATE
ZINC000008454461
ZINC08454461
ZINC8454461

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Available files

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