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

Systemtic Name: 6-azanyl-2-(4-methylpiperidin-1-yl)-N-naphthalen-2-yl-4-oxidanylidene-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-2-(4-methyl-1-piperidyl)-N-(2-naphthyl)-4-oxo-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-2-(4-methyl-1-piperidinyl)-N-(2-naphthalenyl)-4-oxo-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-2-(4-methylpiperidin-1-yl)-N-naphthalen-2-yl-4-oxo-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-4-keto-2-(4-methylpiperidino)-N-(2-naphthyl)-1H-pyrimidine-5-carbothioamide Formula: C21H23N5OS MolecularWeight: 393.50522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1CCN(CC1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H23N5OS/c1-13-8-10-26(11-9-13)21-24-18(22)17(19(27)25-21)20(28)23-16-7-6-14-4-2-3-5-15(14)12-16/h2-7,12-13H,8-11H2,1H3,(H,23,28)(H3,22,24,25,27)