1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H23N4OS2+ MolecularWeight: 351.51002

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C16H22N4OS2/c1-19(12-15-18-13-4-2-3-5-14(13)23-15)16(22)17-6-7-20-8-10-21-11-9-20/h2-5H,6-12H2,1H3,(H,17,22)/p+1