1-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[2-(1-ethylbenzimidazol-2-yl)sulfanylethanoylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[[2-[(1-ethyl-2-benzimidazolyl)thio]-1-oxoethyl]amino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[[2-(1-ethylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[[2-[(1-ethylbenzimidazol-2-yl)thio]acetyl]amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C18H27N6O2S2+ MolecularWeight: 423.57598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)NNC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)NNC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H26N6O2S2/c1-2-24-15-6-4-3-5-14(15)20-18(24)28-13-16(25)21-22-17(27)19-7-8-23-9-11-26-12-10-23/h3-6H,2,7-13H2,1H3,(H,21,25)(H2,19,22,27)/p+1