1-phenethyl-5-[[(4-piperidin-1-ylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-phenethyl-5-[[(4-piperidin-1-ylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-phenethyl-5-[[4-(1-piperidyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-phenethyl-5-[[4-(1-piperidinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-phenethyl-5-[(4-piperidin-1-ylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-phenethyl-5-[(4-piperidinoanilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H26N4O2S MolecularWeight: 434.55384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC=C3C(=O)NC(=S)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC=C3C(=O)NC(=S)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S/c29-22-21(17-25-19-9-11-20(12-10-19)27-14-5-2-6-15-27)23(30)28(24(31)26-22)16-13-18-7-3-1-4-8-18/h1,3-4,7-12,17,25H,2,5-6,13-16H2,(H,26,29,31)