1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-thiourea

Systemtic Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-thiourea Openeye Name: 1-[(3,5-dimethylisoxazol-4-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-thiourea CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]-1-phenylthiourea IUPAC Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1-phenylthiourea Traditional Name: 1-[(3,5-dimethylisoxazol-4-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-thiourea Formula: C19H27N4O2S+ MolecularWeight: 375.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN(C2=CC=CC=C2)C(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C(=NO1)C)CN(C2=CC=CC=C2)C(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C19H26N4O2S/c1-15-18(16(2)25-21-15)14-23(17-6-4-3-5-7-17)19(26)20-8-9-22-10-12-24-13-11-22/h3-7H,8-14H2,1-2H3,(H,20,26)/p+1