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

Systemtic Name: 6-azanyl-N-(3-methylphenyl)-2-(4-methylpiperidin-1-yl)-4-oxidanylidene-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-2-(4-methyl-1-piperidyl)-N-(m-tolyl)-4-oxo-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-N-(3-methylphenyl)-2-(4-methyl-1-piperidinyl)-4-oxo-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-N-(3-methylphenyl)-2-(4-methylpiperidin-1-yl)-4-oxo-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-4-keto-2-(4-methylpiperidino)-N-(m-tolyl)-1H-pyrimidine-5-carbothioamide Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=CC(=C3)C

Isomeric SMILES

CC1CCN(CC1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=CC(=C3)C

InChI

InChI=1S/C18H23N5OS/c1-11-6-8-23(9-7-11)18-21-15(19)14(16(24)22-18)17(25)20-13-5-3-4-12(2)10-13/h3-5,10-11H,6-9H2,1-2H3,(H,20,25)(H3,19,21,22,24)