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

Systemtic Name: N-[5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclobutanecarboxamide Openeye Name: N-[5-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclobutanecarboxamide CAS Name: N-[5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-1,3,4-thiadiazol-2-yl]cyclobutanecarboxamide IUPAC Name: N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclobutanecarboxamide Traditional Name: N-[5-[[2-(benzylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]cyclobutanecarboxamide Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=NN=C(S2)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CC(C1)C(=O)NC2=NN=C(S2)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C16H18N4O2S2/c21-13(17-9-11-5-2-1-3-6-11)10-23-16-20-19-15(24-16)18-14(22)12-7-4-8-12/h1-3,5-6,12H,4,7-10H2,(H,17,21)(H,18,19,22)