2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]-N-(pyridin-4-ylmethylideneamino)ethanamide

Systemtic Name: 2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]-N-(pyridin-4-ylmethylideneamino)ethanamide Openeye Name: 2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]-N-(4-pyridylmethyleneamino)acetamide CAS Name: 2-[5-[[anilino(oxo)methyl]amino]-1,3,4-thiadiazol-2-yl]-N-(pyridin-4-ylmethylideneamino)acetamide IUPAC Name: 2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]-N-(pyridin-4-ylmethylideneamino)acetamide Traditional Name: 2-[5-(phenylcarbamoylamino)-1,3,4-thiadiazol-2-yl]-N-(4-pyridylmethyleneamino)acetamide Formula: C17H15N7O2S MolecularWeight: 381.4117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC(=O)NN=CC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC(=O)NN=CC3=CC=NC=C3

InChI

InChI=1S/C17H15N7O2S/c25-14(22-19-11-12-6-8-18-9-7-12)10-15-23-24-17(27-15)21-16(26)20-13-4-2-1-3-5-13/h1-9,11H,10H2,(H,22,25)(H2,20,21,24,26)