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

Systemtic Name: 1-methyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Openeye Name: 1-methyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea CAS Name: 1-methyl-3-[(Z)-1-[4-(1-piperazin-4-iumylsulfonyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-methyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Traditional Name: 1-methyl-3-[(Z)-1-(4-piperazin-4-ium-1-ylsulfonylphenyl)ethylideneamino]thiourea Formula: C14H22N5O2S2+ MolecularWeight: 356.48678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

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

InChI

InChI=1S/C14H21N5O2S2/c1-11(17-18-14(22)15-2)12-3-5-13(6-4-12)23(20,21)19-9-7-16-8-10-19/h3-6,16H,7-10H2,1-2H3,(H2,15,18,22)/p+1/b17-11-