1-(3-methylphenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-yl-propan-2-yl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-yl-propan-2-yl]urea Openeye Name: 1-[(1R,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-[(1R,2R)-1-(4-morpholin-4-iumyl)-1-thiophen-2-ylpropan-2-yl]urea IUPAC Name: 1-(3-methylphenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-ylpropan-2-yl]urea Traditional Name: 1-[(1R,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-3-(m-tolyl)urea Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC(C)C(C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N[C@H](C)[C@H](C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C19H25N3O2S/c1-14-5-3-6-16(13-14)21-19(23)20-15(2)18(17-7-4-12-25-17)22-8-10-24-11-9-22/h3-7,12-13,15,18H,8-11H2,1-2H3,(H2,20,21,23)/p+1/t15-,18-/m1/s1