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

Systemtic Name: N-[5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-[5-[[2-(benzylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C14H16N4O2S2 MolecularWeight: 336.43244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN=C(S1)SCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=NN=C(S1)SCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C14H16N4O2S2/c1-2-11(19)16-13-17-18-14(22-13)21-9-12(20)15-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,15,20)(H,16,17,19)