2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(1,1-dioxothiolan-3-yl)-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(1,1-dioxo-3-thiolanyl)-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(1,1-dioxothiolan-3-yl)-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(1,1-diketothiolan-3-yl)-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C3CCS(=O)(=O)C3

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C3CCS(=O)(=O)C3

InChI

InChI=1S/C14H17N3O3S/c1-17(10-6-7-21(19,20)9-10)8-13-15-12-5-3-2-4-11(12)14(18)16-13/h2-5,10H,6-9H2,1H3,(H,15,16,18)