(E)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-(3-ethoxy-4-propoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-(3-ethoxy-4-propoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-(3-ethoxy-4-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(1-azepanylsulfonyl)-1-piperazinyl]-3-(3-ethoxy-4-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-(3-ethoxy-4-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(azepan-1-ylsulfonyl)piperazino]-3-(3-ethoxy-4-propoxy-phenyl)prop-2-en-1-one Formula: C24H37N3O5S MolecularWeight: 479.63268

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)OCC

InChI

InChI=1S/C24H37N3O5S/c1-3-19-32-22-11-9-21(20-23(22)31-4-2)10-12-24(28)25-15-17-27(18-16-25)33(29,30)26-13-7-5-6-8-14-26/h9-12,20H,3-8,13-19H2,1-2H3/b12-10+