4-[3-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanoylamino]benzamide

Systemtic Name: 4-[3-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanoylamino]benzamide Openeye Name: 4-[3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanoylamino]benzamide CAS Name: 4-[[3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanoylamino]benzamide Traditional Name: 4-[3-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]propanoylamino]benzamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H21N5O3/c1-25(12-17-23-16-5-3-2-4-15(16)20(28)24-17)11-10-18(26)22-14-8-6-13(7-9-14)19(21)27/h2-9H,10-12H2,1H3,(H2,21,27)(H,22,26)(H,23,24,28)