N-ethyl-4-methyl-3-[6-[(1-methylsulfonylpropan-2-ylamino)methyl]-4-oxidanylidene-quinazolin-3-yl]benzamide

Systemtic Name: N-ethyl-4-methyl-3-[6-[(1-methylsulfonylpropan-2-ylamino)methyl]-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: N-ethyl-4-methyl-3-[6-[[(1-methyl-2-methylsulfonyl-ethyl)amino]methyl]-4-oxo-quinazolin-3-yl]benzamide CAS Name: N-ethyl-4-methyl-3-[6-[(1-methylsulfonylpropan-2-ylamino)methyl]-4-oxo-3-quinazolinyl]benzamide IUPAC Name: N-ethyl-4-methyl-3-[6-[(1-methylsulfonylpropan-2-ylamino)methyl]-4-oxoquinazolin-3-yl]benzamide Traditional Name: N-ethyl-3-[4-keto-6-[[(2-mesyl-1-methyl-ethyl)amino]methyl]quinazolin-3-yl]-4-methyl-benzamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CNC(C)CS(=O)(=O)C

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CNC(C)CS(=O)(=O)C

InChI

InChI=1S/C23H28N4O4S/c1-5-24-22(28)18-8-6-15(2)21(11-18)27-14-26-20-9-7-17(10-19(20)23(27)29)12-25-16(3)13-32(4,30)31/h6-11,14,16,25H,5,12-13H2,1-4H3,(H,24,28)