5-[2-(4-methoxyphenyl)ethyl]-5-(2-pyridin-4-ylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[2-(4-methoxyphenyl)ethyl]-5-(2-pyridin-4-ylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[2-(4-methoxyphenyl)ethyl]-5-[2-(4-pyridyl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[2-(4-methoxyphenyl)ethyl]-5-(2-pyridin-4-ylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[2-(4-methoxyphenyl)ethyl]-5-(2-pyridin-4-ylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[2-(4-methoxyphenyl)ethyl]-5-[2-(4-pyridyl)ethyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2(C(=O)NC(=S)NC2=O)CCC3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CCC2(C(=O)NC(=S)NC2=O)CCC3=CC=NC=C3

InChI

InChI=1S/C20H21N3O3S/c1-26-16-4-2-14(3-5-16)6-10-20(11-7-15-8-12-21-13-9-15)17(24)22-19(27)23-18(20)25/h2-5,8-9,12-13H,6-7,10-11H2,1H3,(H2,22,23,24,25,27)