1-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]thiourea CAS Name: 1-[(Z)-1-[4-(4-ethyl-1-piperazin-4-iumyl)-3-fluorophenyl]ethylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluorophenyl]ethylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]thiourea Formula: C18H27FN5S+ MolecularWeight: 364.503883

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=NNC(=S)NCC=C)C)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)/C(=N\NC(=S)NCC=C)/C)F

InChI

InChI=1S/C18H26FN5S/c1-4-8-20-18(25)22-21-14(3)15-6-7-17(16(19)13-15)24-11-9-23(5-2)10-12-24/h4,6-7,13H,1,5,8-12H2,2-3H3,(H2,20,22,25)/p+1/b21-14-