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

Systemtic Name: N-[3-[(2-chloranylpyridin-3-yl)carbonyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[(2-chloropyridine-3-carbonyl)-methyl-amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[(2-chloro-3-pyridinyl)-oxomethyl]-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[(2-chloropyridine-3-carbonyl)-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[(2-chloronicotinoyl)-methyl-amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C19H18ClN5O3 MolecularWeight: 399.83092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CN(CCCNC(=O)C1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C19H18ClN5O3/c1-25(19(28)13-7-4-9-21-15(13)20)11-5-10-22-18(27)16-23-14-8-3-2-6-12(14)17(26)24-16/h2-4,6-9H,5,10-11H2,1H3,(H,22,27)(H,23,24,26)