1-ethyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-ethyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Openeye Name: 1-ethyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea CAS Name: 1-ethyl-3-[(Z)-1-[4-(1-piperazin-4-iumylsulfonyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-ethyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Traditional Name: 1-ethyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Formula: C15H24N5O2S2+ MolecularWeight: 370.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=C(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCNC(=S)N/N=C(/C)\C1=CC=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H23N5O2S2/c1-3-17-15(23)19-18-12(2)13-4-6-14(7-5-13)24(21,22)20-10-8-16-9-11-20/h4-7,16H,3,8-11H2,1-2H3,(H2,17,19,23)/p+1/b18-12-