3-ethyl-2-[1-[3-methyl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-ethyl-2-[1-[3-methyl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-ethyl-2-[1-[3-methyl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-ethyl-2-[1-[3-methyl-4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-ethyl-2-[1-[3-methyl-4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-ethyl-2-[1-(4-mesitylsulfonyl-3-methyl-piperazino)ethyl]quinazolin-4-one Formula: C26H34N4O3S MolecularWeight: 482.63816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1C(C)N3CCN(C(C3)C)S(=O)(=O)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1C(C)N3CCN(C(C3)C)S(=O)(=O)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C26H34N4O3S/c1-7-29-25(27-23-11-9-8-10-22(23)26(29)31)21(6)28-12-13-30(20(5)16-28)34(32,33)24-18(3)14-17(2)15-19(24)4/h8-11,14-15,20-21H,7,12-13,16H2,1-6H3