3-[6-[(butan-2-ylamino)methyl]-4-oxidanylidene-quinazolin-3-yl]-N-ethyl-4-methyl-benzamide

Systemtic Name: 3-[6-[(butan-2-ylamino)methyl]-4-oxidanylidene-quinazolin-3-yl]-N-ethyl-4-methyl-benzamide Openeye Name: N-ethyl-4-methyl-3-[4-oxo-6-[(sec-butylamino)methyl]quinazolin-3-yl]benzamide CAS Name: 3-[6-[(butan-2-ylamino)methyl]-4-oxo-3-quinazolinyl]-N-ethyl-4-methylbenzamide IUPAC Name: 3-[6-[(butan-2-ylamino)methyl]-4-oxoquinazolin-3-yl]-N-ethyl-4-methylbenzamide Traditional Name: N-ethyl-3-[4-keto-6-[(sec-butylamino)methyl]quinazolin-3-yl]-4-methyl-benzamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC2=C(C=C1)N=CN(C2=O)C3=C(C=CC(=C3)C(=O)NCC)C

Isomeric SMILES

CCC(C)NCC1=CC2=C(C=C1)N=CN(C2=O)C3=C(C=CC(=C3)C(=O)NCC)C

InChI

InChI=1S/C23H28N4O2/c1-5-16(4)25-13-17-8-10-20-19(11-17)23(29)27(14-26-20)21-12-18(9-7-15(21)3)22(28)24-6-2/h7-12,14,16,25H,5-6,13H2,1-4H3,(H,24,28)