N-[3-[(3,4-dimethylphenyl)carbonyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[(3,4-dimethylphenyl)carbonyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[(3,4-dimethylbenzoyl)-methyl-amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[(3,4-dimethylphenyl)-oxomethyl]-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[(3,4-dimethylbenzoyl)-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[(3,4-dimethylbenzoyl)-methyl-amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3/c1-14-9-10-16(13-15(14)2)22(29)26(3)12-6-11-23-21(28)19-24-18-8-5-4-7-17(18)20(27)25-19/h4-5,7-10,13H,6,11-12H2,1-3H3,(H,23,28)(H,24,25,27)