6-azanyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbothioamide

Systemtic Name: 6-azanyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-2-(2-methylindolin-1-yl)-N-(m-tolyl)-4-oxo-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)-4-oxo-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)-4-oxo-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-4-keto-2-(2-methylindolin-1-yl)-N-(m-tolyl)-1H-pyrimidine-5-carbothioamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC(=O)C(=C(N3)N)C(=S)NC4=CC=CC(=C4)C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC(=O)C(=C(N3)N)C(=S)NC4=CC=CC(=C4)C

InChI

InChI=1S/C21H21N5OS/c1-12-6-5-8-15(10-12)23-20(28)17-18(22)24-21(25-19(17)27)26-13(2)11-14-7-3-4-9-16(14)26/h3-10,13H,11H2,1-2H3,(H,23,28)(H3,22,24,25,27)