4-[2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[[5-(2-furylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[5-(2-furanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[[5-(2-furfurylamino)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]benzamide Formula: C16H15N5O3S2 MolecularWeight: 389.452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=COC(=C1)CNC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C16H15N5O3S2/c17-14(23)10-3-5-11(6-4-10)19-13(22)9-25-16-21-20-15(26-16)18-8-12-2-1-7-24-12/h1-7H,8-9H2,(H2,17,23)(H,18,20)(H,19,22)