1-(1-methylpiperidin-1-ium-4-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(1-methylpiperidin-1-ium-4-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-(1-methylpiperidin-1-ium-4-yl)-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-(1-methyl-4-piperidin-1-iumyl)-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(1-methylpiperidin-1-ium-4-yl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(1-methylpiperidin-1-ium-4-yl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C17H27N4O3S2+ MolecularWeight: 399.55128

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H26N4O3S2/c1-20-8-6-15(7-9-20)19-17(25)18-14-2-4-16(5-3-14)26(22,23)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H2,18,19,25)/p+1