4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-N-pyridin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-N-pyridin-2-yl-benzenesulfonamide Openeye Name: 4-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-N-(2-pyridyl)benzenesulfonamide CAS Name: 4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-N-(2-pyridinyl)benzenesulfonamide IUPAC Name: 4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-N-pyridin-2-ylbenzenesulfonamide Traditional Name: 4-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-N-(2-pyridyl)benzenesulfonamide Formula: C16H13N5O4S2 MolecularWeight: 403.43552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=O)NC(=S)NC3=O

Isomeric SMILES

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C16H13N5O4S2/c22-14-12(15(23)20-16(26)19-14)9-18-10-4-6-11(7-5-10)27(24,25)21-13-3-1-2-8-17-13/h1-9,18H,(H,17,21)(H2,19,20,22,23,26)