2-(2-ethoxy-5-piperazin-1-ylsulfonyl-phenyl)-5-methyl-1H-quinazolin-4-one

Systemtic Name: 2-(2-ethoxy-5-piperazin-1-ylsulfonyl-phenyl)-5-methyl-1H-quinazolin-4-one Openeye Name: 2-(2-ethoxy-5-piperazin-1-ylsulfonyl-phenyl)-5-methyl-1H-quinazolin-4-one CAS Name: 2-[2-ethoxy-5-(1-piperazinylsulfonyl)phenyl]-5-methyl-1H-quinazolin-4-one IUPAC Name: 2-(2-ethoxy-5-piperazin-1-ylsulfonylphenyl)-5-methyl-1H-quinazolin-4-one Traditional Name: 2-(2-ethoxy-5-piperazinosulfonyl-phenyl)-5-methyl-1H-quinazolin-4-one Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCNCC2)C3=NC(=O)C4=C(C=CC=C4N3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCNCC2)C3=NC(=O)C4=C(C=CC=C4N3)C

InChI

InChI=1S/C21H24N4O4S/c1-3-29-18-8-7-15(30(27,28)25-11-9-22-10-12-25)13-16(18)20-23-17-6-4-5-14(2)19(17)21(26)24-20/h4-8,13,22H,3,9-12H2,1-2H3,(H,23,24,26)