2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]isoindole-1,3-dione

Systemtic Name: 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]isoindole-1,3-dione Openeye Name: 2-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]isoindoline-1,3-dione CAS Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]isoindole-1,3-dione IUPAC Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]isoindole-1,3-dione Traditional Name: 2-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]isoindoline-1,3-quinone Formula: C13H8N4O4S MolecularWeight: 316.29202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)NC=C3C(=O)NC(=S)NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)NC=C3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C13H8N4O4S/c18-9-8(10(19)16-13(22)15-9)5-14-17-11(20)6-3-1-2-4-7(6)12(17)21/h1-5,14H,(H2,15,16,18,19,22)