1-phenyl-3-(2-piperazin-4-ium-1-ylethyl)thiourea

Systemtic Name: 1-phenyl-3-(2-piperazin-4-ium-1-ylethyl)thiourea Openeye Name: 1-phenyl-3-(2-piperazin-4-ium-1-ylethyl)thiourea CAS Name: 1-phenyl-3-[2-(1-piperazin-4-iumyl)ethyl]thiourea IUPAC Name: 1-phenyl-3-(2-piperazin-4-ium-1-ylethyl)thiourea Traditional Name: 1-phenyl-3-(2-piperazin-4-ium-1-ylethyl)thiourea Formula: C13H21N4S+ MolecularWeight: 265.39764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCNC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH2+]1)CCNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C13H20N4S/c18-13(16-12-4-2-1-3-5-12)15-8-11-17-9-6-14-7-10-17/h1-5,14H,6-11H2,(H2,15,16,18)/p+1