4-oxidanylidene-N-[2-[2,2,2-tris(chloranyl)ethanoylamino]ethyl]-1H-quinazoline-2-carboxamide

Systemtic Name: 4-oxidanylidene-N-[2-[2,2,2-tris(chloranyl)ethanoylamino]ethyl]-1H-quinazoline-2-carboxamide Openeye Name: 4-oxo-N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-1H-quinazoline-2-carboxamide CAS Name: 4-oxo-N-[2-[(2,2,2-trichloro-1-oxoethyl)amino]ethyl]-1H-quinazoline-2-carboxamide IUPAC Name: 4-oxo-N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-1H-quinazoline-2-carboxamide Formula: C13H11Cl3N4O3 MolecularWeight: 377.61044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCNC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCNC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H11Cl3N4O3/c14-13(15,16)12(23)18-6-5-17-11(22)9-19-8-4-2-1-3-7(8)10(21)20-9/h1-4H,5-6H2,(H,17,22)(H,18,23)(H,19,20,21)