1-[3-[5-(4-phenylpiperazin-1-yl)pentoxy]phenyl]thiourea

Systemtic Name: 1-[3-[5-(4-phenylpiperazin-1-yl)pentoxy]phenyl]thiourea Openeye Name: [3-[5-(4-phenylpiperazin-1-yl)pentoxy]phenyl]thiourea CAS Name: [3-[5-(4-phenyl-1-piperazinyl)pentoxy]phenyl]thiourea IUPAC Name: [3-[5-(4-phenylpiperazin-1-yl)pentoxy]phenyl]thiourea Traditional Name: [3-[5-(4-phenylpiperazino)pentoxy]phenyl]thiourea Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCOC2=CC=CC(=C2)NC(=S)N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCCCOC2=CC=CC(=C2)NC(=S)N)C3=CC=CC=C3

InChI

InChI=1S/C22H30N4OS/c23-22(28)24-19-8-7-11-21(18-19)27-17-6-2-5-12-25-13-15-26(16-14-25)20-9-3-1-4-10-20/h1,3-4,7-11,18H,2,5-6,12-17H2,(H3,23,24,28)