N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[3-(4-ethylpiperazino)sulfonylphenyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C24H29N5O4S MolecularWeight: 483.58316

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C24H29N5O4S/c1-3-27-12-14-29(15-13-27)34(32,33)20-8-5-7-19(16-20)26-22(30)10-11-28-17-25-23-18(2)6-4-9-21(23)24(28)31/h4-9,16-17H,3,10-15H2,1-2H3,(H,26,30)