1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-thiourea

Systemtic Name: 1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-thiourea Openeye Name: 1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-thiourea CAS Name: 1-[3-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]propyl]-3-phenylthiourea IUPAC Name: 1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenylthiourea Traditional Name: 1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-thiourea Formula: C21H29N4OS+ MolecularWeight: 385.54616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H28N4OS/c1-26-20-10-8-19(9-11-20)25-16-14-24(15-17-25)13-5-12-22-21(27)23-18-6-3-2-4-7-18/h2-4,6-11H,5,12-17H2,1H3,(H2,22,23,27)/p+1