methyl 5-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C16H15N3O3S2 MolecularWeight: 361.4386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NN=C(S2)NCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NN=C(S2)NCC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O3S2/c1-21-14(20)13-8-7-12(22-13)10-23-16-19-18-15(24-16)17-9-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,17,18)