(6E)-5-azanylidene-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]indol-3-yl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6E)-5-azanylidene-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]indol-3-yl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6E)-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]indol-3-yl]methylene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6E)-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]-3-indolyl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6E)-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]indol-3-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6E)-6-[[1-[2-(3,5-dimethylphenoxy)ethyl]indol-3-yl]methylene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C27H27N5O2S MolecularWeight: 485.60058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN2C(=N)C(=CC3=CN(C4=CC=CC=C43)CCOC5=CC(=CC(=C5)C)C)C(=O)N=C2S1

Isomeric SMILES

CCCC1=NN2C(=N)/C(=C\C3=CN(C4=CC=CC=C43)CCOC5=CC(=CC(=C5)C)C)/C(=O)N=C2S1

InChI

InChI=1S/C27H27N5O2S/c1-4-7-24-30-32-25(28)22(26(33)29-27(32)35-24)15-19-16-31(23-9-6-5-8-21(19)23)10-11-34-20-13-17(2)12-18(3)14-20/h5-6,8-9,12-16,28H,4,7,10-11H2,1-3H3/b22-15+,28-25?