1-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-thiophen-2-yl-urea

Systemtic Name: 1-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-thiophen-2-yl-urea Openeye Name: 1-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(2-thienyl)urea CAS Name: 1-[5-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]-3-thiophen-2-ylurea IUPAC Name: 1-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-thiophen-2-ylurea Traditional Name: 1-[5-(2-pyrrolidin-1-ium-1-ylethylthio)-1,3,4-thiadiazol-2-yl]-3-(2-thienyl)urea Formula: C13H18N5OS3+ MolecularWeight: 356.50992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCSC2=NN=C(S2)NC(=O)NC3=CC=CS3

Isomeric SMILES

C1CC[NH+](C1)CCSC2=NN=C(S2)NC(=O)NC3=CC=CS3

InChI

InChI=1S/C13H17N5OS3/c19-11(14-10-4-3-8-20-10)15-12-16-17-13(22-12)21-9-7-18-5-1-2-6-18/h3-4,8H,1-2,5-7,9H2,(H2,14,15,16,19)/p+1