(3-ethoxy-4-propoxy-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-ethoxy-4-propoxy-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-ethoxy-4-propoxy-phenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-ethoxy-4-propoxyphenyl)-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: (3-ethoxy-4-propoxyphenyl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-ethoxy-4-propoxy-phenyl)-[4-(4-methylpiperazino)sulfonylpiperazino]methanone Formula: C21H34N4O5S MolecularWeight: 454.58346

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCN(CC3)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCN(CC3)C)OCC

InChI

InChI=1S/C21H34N4O5S/c1-4-16-30-19-7-6-18(17-20(19)29-5-2)21(26)23-10-14-25(15-11-23)31(27,28)24-12-8-22(3)9-13-24/h6-7,17H,4-5,8-16H2,1-3H3