N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[3-(4-ethylpiperazino)sulfonylphenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C24H29N5O4S MolecularWeight: 483.58316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H29N5O4S/c1-2-27-13-15-29(16-14-27)34(32,33)20-8-5-7-19(17-20)26-23(30)11-6-12-28-18-25-22-10-4-3-9-21(22)24(28)31/h3-5,7-10,17-18H,2,6,11-16H2,1H3,(H,26,30)