N-aminocarbonyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: N-carbamoyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-carbamoylpropanamide Traditional Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-N-carbamoyl-propionamide Formula: C13H15N5O2S2 MolecularWeight: 337.4205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(S1)NCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(S1)NCC2=CC=CC=C2

InChI

InChI=1S/C13H15N5O2S2/c1-8(10(19)16-11(14)20)21-13-18-17-12(22-13)15-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,17)(H3,14,16,19,20)