1-(2-methyl-1,3-benzoxazol-5-yl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(2-methyl-1,3-benzoxazol-5-yl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C15H21N4O2S+ MolecularWeight: 321.41784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C15H20N4O2S/c1-11-17-13-10-12(2-3-14(13)21-11)18-15(22)16-4-5-19-6-8-20-9-7-19/h2-3,10H,4-9H2,1H3,(H2,16,18,22)/p+1