4-chloranyl-N-[5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-chloro-N-[5-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-chloro-N-[5-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-chloro-N-[5-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-chloro-N-[5-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H13ClN4O3S2 MolecularWeight: 408.88242

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)CNC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4O3S2/c17-11-5-3-10(4-6-11)14(23)19-15-20-21-16(26-15)25-9-13(22)18-8-12-2-1-7-24-12/h1-7H,8-9H2,(H,18,22)(H,19,20,23)