1-(3-methylphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-methylphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(m-tolyl)-5-[[3-(1-piperidyl)propylamino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-methylphenyl)-5-[[3-(1-piperidinyl)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-methylphenyl)-5-[(3-piperidin-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(m-tolyl)-5-[(3-piperidinopropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H26N4O2S MolecularWeight: 386.51104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CNCCCN3CCCCC3)C(=O)NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C(=CNCCCN3CCCCC3)C(=O)NC2=S

InChI

InChI=1S/C20H26N4O2S/c1-15-7-5-8-16(13-15)24-19(26)17(18(25)22-20(24)27)14-21-9-6-12-23-10-3-2-4-11-23/h5,7-8,13-14,21H,2-4,6,9-12H2,1H3,(H,22,25,27)