5-[3-[bis(2-oxidanyl-3-phenoxy-propyl)amino]propyl]-N-butyl-thiophene-2-carboxamide

Systemtic Name: 5-[3-[bis(2-oxidanyl-3-phenoxy-propyl)amino]propyl]-N-butyl-thiophene-2-carboxamide Openeye Name: 5-[3-[bis(2-hydroxy-3-phenoxy-propyl)amino]propyl]-N-butyl-thiophene-2-carboxamide CAS Name: 5-[3-[bis(2-hydroxy-3-phenoxypropyl)amino]propyl]-N-butyl-2-thiophenecarboxamide IUPAC Name: 5-[3-[bis(2-hydroxy-3-phenoxypropyl)amino]propyl]-N-butylthiophene-2-carboxamide Traditional Name: 5-[3-[bis(2-hydroxy-3-phenoxy-propyl)amino]propyl]-N-butyl-thiophene-2-carboxamide Formula: C30H40N2O5S MolecularWeight: 540.714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(S1)CCCN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

Isomeric SMILES

CCCCNC(=O)C1=CC=C(S1)CCCN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C30H40N2O5S/c1-2-3-18-31-30(35)29-17-16-28(38-29)15-10-19-32(20-24(33)22-36-26-11-6-4-7-12-26)21-25(34)23-37-27-13-8-5-9-14-27/h4-9,11-14,16-17,24-25,33-34H,2-3,10,15,18-23H2,1H3,(H,31,35)