2-azanyl-N-[5-[2-azanyl-3-(4-phenylmethoxyphenyl)propanoyl]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]-N-phenyl-ethanamide

Systemtic Name: 2-azanyl-N-[5-[2-azanyl-3-(4-phenylmethoxyphenyl)propanoyl]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]-N-phenyl-ethanamide Openeye Name: 2-amino-N-[5-[2-amino-3-(4-benzyloxyphenyl)propanoyl]-2-thioxo-1,3,4-thiadiazol-3-yl]-N-phenyl-acetamide CAS Name: 2-amino-N-[5-[2-amino-1-oxo-3-(4-phenylmethoxyphenyl)propyl]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]-N-phenylacetamide IUPAC Name: 2-amino-N-[5-[2-amino-3-(4-phenylmethoxyphenyl)propanoyl]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]-N-phenylacetamide Traditional Name: 2-amino-N-[5-[2-amino-3-(4-benzoxyphenyl)propanoyl]-2-thioxo-1,3,4-thiadiazol-3-yl]-N-phenyl-acetamide Formula: C26H25N5O3S2 MolecularWeight: 519.6384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)C3=NN(C(=S)S3)N(C4=CC=CC=C4)C(=O)CN)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)C3=NN(C(=S)S3)N(C4=CC=CC=C4)C(=O)CN)N

InChI

InChI=1S/C26H25N5O3S2/c27-16-23(32)30(20-9-5-2-6-10-20)31-26(35)36-25(29-31)24(33)22(28)15-18-11-13-21(14-12-18)34-17-19-7-3-1-4-8-19/h1-14,22H,15-17,27-28H2