5-azanylidene-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 5-imino-6-[[1-(m-tolylmethyl)indol-3-yl]methylene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-6-[[1-[(3-methylphenyl)methyl]-3-indolyl]methylidene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 5-imino-6-[[1-(3-methylbenzyl)indol-3-yl]methylene]-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C23H16F3N5OS MolecularWeight: 467.46625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=N)N5C(=NC4=O)SC(=N5)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=N)N5C(=NC4=O)SC(=N5)C(F)(F)F

InChI

InChI=1S/C23H16F3N5OS/c1-13-5-4-6-14(9-13)11-30-12-15(16-7-2-3-8-18(16)30)10-17-19(27)31-22(28-20(17)32)33-21(29-31)23(24,25)26/h2-10,12,27H,11H2,1H3