1-(3-morpholin-4-ium-4-ylpropyl)-3-[(S)-(4-propylphenyl)-thiophen-2-yl-methyl]thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(S)-(4-propylphenyl)-thiophen-2-yl-methyl]thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(S)-(4-propylphenyl)-(2-thienyl)methyl]thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[(S)-(4-propylphenyl)-thiophen-2-ylmethyl]thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(S)-(4-propylphenyl)-thiophen-2-ylmethyl]thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(S)-(4-propylphenyl)-(2-thienyl)methyl]thiourea Formula: C22H32N3OS2+ MolecularWeight: 418.63898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C22H31N3OS2/c1-2-5-18-7-9-19(10-8-18)21(20-6-3-17-28-20)24-22(27)23-11-4-12-25-13-15-26-16-14-25/h3,6-10,17,21H,2,4-5,11-16H2,1H3,(H2,23,24,27)/p+1/t21-/m0/s1