2-(3-[(1-(4-CHLOROPHENYL)-3-ETHYL-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE

CAS No.
CCD No.
CCD00406875
Formula
C28 H25 Cl N4 O2 S2
MolWeight
549.117

Basic Information

Product Name: 2-(3-[(1-(4-CHLOROPHENYL)-3-ETHYL-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
English Synonyms: 2-(3-[(1-(4-CHLOROPHENYL)-3-ETHYL-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
MDL Number.: MFCD03696844
H bond acceptor: 6
H bond donor: 0
Smile: CCN1C(=O)/C(=C\c2cc(n(c2C)c3c(c4c(s3)CCCC4)C#N)C)/C(=O)N(C1=S)c5ccc(cc5)Cl
InChi: InChI=1S/C28H25ClN4O2S2/c1-4-31-25(34)22(26(35)33(28(31)36)20-11-9-19(29)10-12-20)14-18-13-16(2)32(17(18)3)27-23(15-30)21-7-5-6-8-24(21)37-27/h9-14H,4-8H2,1-3H3/b22-14+
InChiKey: InChIKey=YXSIVYPOBQCTRY-HYARGMPZSA-N

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