2,2-dimethyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2,2-dimethyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[[anilino(sulfanylidene)methyl]amino]-1,3,4-thiadiazol-2-yl]-2,2-dimethylpropanamide IUPAC Name: 2,2-dimethyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2,2-dimethyl-N-[5-(phenylthiocarbamoylamino)-1,3,4-thiadiazol-2-yl]propionamide Formula: C14H17N5OS2 MolecularWeight: 335.44768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NN=C(S1)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)NC1=NN=C(S1)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C14H17N5OS2/c1-14(2,3)10(20)16-12-18-19-13(22-12)17-11(21)15-9-7-5-4-6-8-9/h4-8H,1-3H3,(H,16,18,20)(H2,15,17,19,21)