1-phenyl-5-(phenylazanylmethyl)-3-pyridin-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-phenyl-5-(phenylazanylmethyl)-3-pyridin-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(anilinomethyl)-1-phenyl-3-(2-pyridyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(anilinomethyl)-1-phenyl-3-(2-pyridinyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(anilinomethyl)-1-phenyl-3-pyridin-2-yl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(anilinomethyl)-1-phenyl-3-(2-pyridyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC2C(=O)N(C(=S)N(C2=O)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NCC2C(=O)N(C(=S)N(C2=O)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O2S/c27-20-18(15-24-16-9-3-1-4-10-16)21(28)26(19-13-7-8-14-23-19)22(29)25(20)17-11-5-2-6-12-17/h1-14,18,24H,15H2