4-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[4-[(3,5-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]phenyl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[4-[(3,5-dimethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzoyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-[[(3,5-dimethyl-4-oxo-2-quinazolinyl)thio]methyl]phenyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-[(3,5-dimethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzoyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[[(4-keto-3,5-dimethyl-quinazolin-2-yl)thio]methyl]benzoyl]piperazine-1-carbaldehyde Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C23H24N4O3S/c1-16-4-3-5-19-20(16)22(30)25(2)23(24-19)31-14-17-6-8-18(9-7-17)21(29)27-12-10-26(15-28)11-13-27/h3-9,15H,10-14H2,1-2H3