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

Systemtic Name: 2-ethyl-N-[5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-ethyl-butanamide CAS Name: 2-ethyl-N-[5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-ethylbutanamide Traditional Name: N-[5-[[2-(benzylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-2-ethyl-butyramide Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O2S2/c1-3-13(4-2)15(23)19-16-20-21-17(25-16)24-11-14(22)18-10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,18,22)(H,19,20,23)