(2,5-dimethylphenyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2,5-dimethylphenyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2,5-dimethylphenyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2,5-dimethylphenyl)-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2,5-dimethylphenyl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2,5-dimethylphenyl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H26N2O4S/c1-4-27-18-7-9-19(10-8-18)28(25,26)23-13-11-22(12-14-23)21(24)20-15-16(2)5-6-17(20)3/h5-10,15H,4,11-14H2,1-3H3