N-ethoxy-4-methyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-oxidanylidene-quinazolin-3-yl]benzamide

Systemtic Name: N-ethoxy-4-methyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: N-ethoxy-4-methyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-oxo-quinazolin-3-yl]benzamide CAS Name: N-ethoxy-4-methyl-3-[6-[(4-methylsulfonyl-1-piperazinyl)methyl]-4-oxo-3-quinazolinyl]benzamide IUPAC Name: N-ethoxy-4-methyl-3-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-oxoquinazolin-3-yl]benzamide Traditional Name: N-ethoxy-3-[4-keto-6-[(4-mesylpiperazino)methyl]quinazolin-3-yl]-4-methyl-benzamide Formula: C24H29N5O5S MolecularWeight: 499.58256

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCONC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C24H29N5O5S/c1-4-34-26-23(30)19-7-5-17(2)22(14-19)29-16-25-21-8-6-18(13-20(21)24(29)31)15-27-9-11-28(12-10-27)35(3,32)33/h5-8,13-14,16H,4,9-12,15H2,1-3H3,(H,26,30)