1-[4-[4-(hydroxymethyl)phenyl]butyl]-3-[2-oxidanyl-3-[[5-(4-phenylphenyl)thiophen-2-yl]amino]propyl]urea

Systemtic Name: 1-[4-[4-(hydroxymethyl)phenyl]butyl]-3-[2-oxidanyl-3-[[5-(4-phenylphenyl)thiophen-2-yl]amino]propyl]urea Openeye Name: 1-[4-[4-(hydroxymethyl)phenyl]butyl]-3-[2-hydroxy-3-[[5-(4-phenylphenyl)-2-thienyl]amino]propyl]urea CAS Name: 1-[4-[4-(hydroxymethyl)phenyl]butyl]-3-[2-hydroxy-3-[[5-(4-phenylphenyl)-2-thiophenyl]amino]propyl]urea IUPAC Name: 1-[4-[4-(hydroxymethyl)phenyl]butyl]-3-[2-hydroxy-3-[[5-(4-phenylphenyl)thiophen-2-yl]amino]propyl]urea Traditional Name: 1-[2-hydroxy-3-[[5-(4-phenylphenyl)-2-thienyl]amino]propyl]-3-[4-(4-methylolphenyl)butyl]urea Formula: C31H35N3O3S MolecularWeight: 529.6929

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(S3)NCC(CNC(=O)NCCCCC4=CC=C(C=C4)CO)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(S3)NCC(CNC(=O)NCCCCC4=CC=C(C=C4)CO)O

InChI

InChI=1S/C31H35N3O3S/c35-22-24-11-9-23(10-12-24)6-4-5-19-32-31(37)34-21-28(36)20-33-30-18-17-29(38-30)27-15-13-26(14-16-27)25-7-2-1-3-8-25/h1-3,7-18,28,33,35-36H,4-6,19-22H2,(H2,32,34,37)