N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: 4-oxo-N-[2-(p-tolylsulfonylamino)ethyl]-1H-quinazoline-2-carboxamide CAS Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[2-(tosylamino)ethyl]-1H-quinazoline-2-carboxamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H18N4O4S/c1-12-6-8-13(9-7-12)27(25,26)20-11-10-19-18(24)16-21-15-5-3-2-4-14(15)17(23)22-16/h2-9,20H,10-11H2,1H3,(H,19,24)(H,21,22,23)