1-prop-2-enyl-5-[[[4-(pyridin-4-ylmethyl)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-prop-2-enyl-5-[[[4-(pyridin-4-ylmethyl)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[[4-(4-pyridylmethyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-prop-2-enyl-5-[[4-(pyridin-4-ylmethyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-prop-2-enyl-5-[[4-(pyridin-4-ylmethyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[[4-(4-pyridylmethyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CNC2=CC=C(C=C2)CC3=CC=NC=C3)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CNC2=CC=C(C=C2)CC3=CC=NC=C3)C(=O)NC1=S

InChI

InChI=1S/C20H18N4O2S/c1-2-11-24-19(26)17(18(25)23-20(24)27)13-22-16-5-3-14(4-6-16)12-15-7-9-21-10-8-15/h2-10,13,22H,1,11-12H2,(H,23,25,27)