1,1,3-trimethyl-3-[5-(quinolin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1,1,3-trimethyl-3-[5-(quinolin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1,1,3-trimethyl-3-[5-(3-quinolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1,1,3-trimethyl-3-[5-(3-quinolinylmethylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1,1,3-trimethyl-3-[5-(quinolin-3-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1,1,3-trimethyl-3-[5-(3-quinolylmethylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N(C)C1=NN=C(S1)SCC2=CC3=CC=CC=C3N=C2

Isomeric SMILES

CN(C)C(=O)N(C)C1=NN=C(S1)SCC2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C16H17N5OS2/c1-20(2)16(22)21(3)14-18-19-15(24-14)23-10-11-8-12-6-4-5-7-13(12)17-9-11/h4-9H,10H2,1-3H3