1-(3-chloranyl-2-methyl-phenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-yl-propan-2-yl]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-yl-propan-2-yl]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(1R,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(1R,2R)-1-(4-morpholin-4-iumyl)-1-thiophen-2-ylpropan-2-yl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(1R,2R)-1-morpholin-4-ium-4-yl-1-thiophen-2-ylpropan-2-yl]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(1R,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]thiourea Formula: C19H25ClN3OS2+ MolecularWeight: 411.0043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC(C)C(C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N[C@H](C)[C@H](C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C19H24ClN3OS2/c1-13-15(20)5-3-6-16(13)22-19(25)21-14(2)18(17-7-4-12-26-17)23-8-10-24-11-9-23/h3-7,12,14,18H,8-11H2,1-2H3,(H2,21,22,25)/p+1/t14-,18-/m1/s1