(6E)-5-azanylidene-6-[[2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6E)-5-azanylidene-6-[[2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6E)-2-(1-ethylpropyl)-5-imino-6-[[1-(4-isopropylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6E)-6-[[2,5-dimethyl-1-(4-propan-2-ylphenyl)-3-pyrrolyl]methylidene]-5-imino-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6E)-6-[[2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]methylidene]-5-imino-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6E)-6-[(2,5-dimethyl-1-p-cumenyl-pyrrol-3-yl)methylene]-2-(1-ethylpropyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C26H31N5OS MolecularWeight: 461.62224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN2C(=N)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)C(C)C)C)C(=O)N=C2S1

Isomeric SMILES

CCC(CC)C1=NN2C(=N)/C(=C\C3=C(N(C(=C3)C)C4=CC=C(C=C4)C(C)C)C)/C(=O)N=C2S1

InChI

InChI=1S/C26H31N5OS/c1-7-18(8-2)25-29-31-23(27)22(24(32)28-26(31)33-25)14-20-13-16(5)30(17(20)6)21-11-9-19(10-12-21)15(3)4/h9-15,18,27H,7-8H2,1-6H3/b22-14+,27-23?