1-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-(furan-2-ylmethyl)urea

Systemtic Name: 1-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-(furan-2-ylmethyl)urea Openeye Name: 1-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-3-(2-furylmethyl)urea CAS Name: 1-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-3-(2-furanylmethyl)urea IUPAC Name: 1-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-(furan-2-ylmethyl)urea Traditional Name: 1-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-3-(2-furfuryl)urea Formula: C17H12ClN5O2S2 MolecularWeight: 417.89248

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1=COC(=C1)CNC(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C17H12ClN5O2S2/c18-10-3-4-12-13(8-10)19-6-5-14(12)26-17-23-22-16(27-17)21-15(24)20-9-11-2-1-7-25-11/h1-8H,9H2,(H2,20,21,22,24)