1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(Z)-1-(4-mesylphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H25N4O3S2+ MolecularWeight: 385.5247

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC[NH+]1CCOCC1)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

C/C(=N/NC(=S)NCC[NH+]1CCOCC1)/C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H24N4O3S2/c1-13(14-3-5-15(6-4-14)25(2,21)22)18-19-16(24)17-7-8-20-9-11-23-12-10-20/h3-6H,7-12H2,1-2H3,(H2,17,19,24)/p+1/b18-13-