N-[3-[(3-methylphenyl)carbonylamino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[(3-methylphenyl)carbonylamino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[(3-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[(3-methylphenyl)-oxomethyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[(3-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[3-(m-toluoylamino)propyl]-1H-quinazoline-2-carboxamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O3/c1-13-6-4-7-14(12-13)18(25)21-10-5-11-22-20(27)17-23-16-9-3-2-8-15(16)19(26)24-17/h2-4,6-9,12H,5,10-11H2,1H3,(H,21,25)(H,22,27)(H,23,24,26)