N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenylpiperazin-1-yl)methyl]-4-thiophen-3-yl-phenoxy]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenylpiperazin-1-yl)methyl]-4-thiophen-3-yl-phenoxy]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenylpiperazin-1-yl)methyl]-4-(3-thienyl)phenoxy]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenyl-1-piperazinyl)methyl]-4-(3-thiophenyl)phenoxy]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenylpiperazin-1-yl)methyl]-4-thiophen-3-ylphenoxy]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-[(4-phenylpiperazino)methyl]-4-(3-thienyl)phenoxy]acetamide Formula: C32H33N3O4S MolecularWeight: 555.68712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)C3=CSC=C3)OCC(=O)NCC4COC5=CC=CC=C5O4)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)C3=CSC=C3)OCC(=O)NCC4COC5=CC=CC=C5O4)C6=CC=CC=C6

InChI

InChI=1S/C32H33N3O4S/c36-32(33-19-28-21-37-30-8-4-5-9-31(30)39-28)22-38-29-11-10-24(25-12-17-40-23-25)18-26(29)20-34-13-15-35(16-14-34)27-6-2-1-3-7-27/h1-12,17-18,23,28H,13-16,19-22H2,(H,33,36)