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

Systemtic Name: 4-[[1-cyclopropyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: 4-[(1-cyclopropyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 4-[(1-cyclopropyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoate IUPAC Name: 4-[(1-cyclopropyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 4-[(1-cyclopropyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate Formula: C15H12N3O4S- MolecularWeight: 330.33848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C(=CNC3=CC=C(C=C3)C(=O)[O-])C(=O)NC2=S

Isomeric SMILES

C1CC1N2C(=O)C(=CNC3=CC=C(C=C3)C(=O)[O-])C(=O)NC2=S

InChI

InChI=1S/C15H13N3O4S/c19-12-11(13(20)18(10-5-6-10)15(23)17-12)7-16-9-3-1-8(2-4-9)14(21)22/h1-4,7,10,16H,5-6H2,(H,21,22)(H,17,19,23)/p-1