1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O3/c26-21(23-17-7-8-19-20(15-17)28-16-27-19)22-9-4-10-24-11-13-25(14-12-24)18-5-2-1-3-6-18/h1-3,5-8,15H,4,9-14,16H2,(H2,22,23,26)