1-[2-(cyclohexen-1-yl)ethyl]-5-[(pyridin-3-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-[2-(cyclohexen-1-yl)ethyl]-5-[(pyridin-3-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-[2-(cyclohexen-1-yl)ethyl]-5-[(3-pyridylmethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-[2-(1-cyclohexenyl)ethyl]-5-[(3-pyridinylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-[2-(cyclohexen-1-yl)ethyl]-5-[(pyridin-3-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-[2-(cyclohexen-1-yl)ethyl]-5-[(3-pyridylmethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=O)C(=CNCC3=CN=CC=C3)C(=O)NC2=S

Isomeric SMILES

C1CCC(=CC1)CCN2C(=O)C(=CNCC3=CN=CC=C3)C(=O)NC2=S

InChI

InChI=1S/C19H22N4O2S/c24-17-16(13-21-12-15-7-4-9-20-11-15)18(25)23(19(26)22-17)10-8-14-5-2-1-3-6-14/h4-5,7,9,11,13,21H,1-3,6,8,10,12H2,(H,22,24,26)