1-(2-morpholin-4-ium-4-ylethyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-isopropylphenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(p-cumenylthiocarbamoylamino)thiourea Formula: C17H28N5OS2+ MolecularWeight: 382.56712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C17H27N5OS2/c1-13(2)14-3-5-15(6-4-14)19-17(25)21-20-16(24)18-7-8-22-9-11-23-12-10-22/h3-6,13H,7-12H2,1-2H3,(H2,18,20,24)(H2,19,21,25)/p+1