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2-(3-{(Z)-[1-(3,5-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)-N-(4-methylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK189636
SMILES Cc1ccc(cc1)NC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C\1/C(=O)NC(=S)N(C1=O)c1cc(C)cc(c1)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 C35H34N4O3S2 MW 622.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N4O3S2/c1-19-10-12-25(13-11-19)36-32(41)30-27-8-6-7-9-29(27)44-34(30)38-22(4)17-24(23(38)5)18-28-31(40)37-35(43)39(33(28)42)26-15-20(2)14-21(3)16-26/h10-18H,6-9H2,1-5H3,(H,36,41)(H,37,40,43)/b28-18-
InChIKey
NSHQJIARFLDTCL-VEILYXNESA-N
Synonyms

2(3((Z)(1(35dimethylphenyl)46dioxo2sulfanylidene13diazinan5ylidene)methyl)25dimethylpyrrol1yl)N(4methylphenyl)4567tetrahydro1benzothiophene3carboxamide
2(3((Z)(1(35dimethylphenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)25dimethyl1Hpyrrol1yl)N(4methylphenyl)4567tetrahydro1benzothiophene3carboxamide
CC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)N4C(=CC(=C4C)C=C5C(=O)NC(=S)N(C5=O)C6=CC(=CC(=C6)C)C)C
Cc1ccc(cc1)NC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1C(=O)NC(=S)N(C1=O)c1cc(C)cc(c1)C
InChI=1SC35H34N4O3S2c119101225(131119)3632(41)3027867929(27)4434(30)3822(4)1724(23(38)5)182831(40)3735(43)39(33(28)42)261520(2)1421(3)1626h1018H69H215H3(H3641)(H374043)b2818
MFCD04561235
ZINC000097960951
ZINC97960951

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Available files

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