(2S)-2-methyl-5-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: (2S)-2-methyl-5-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1,4-diazepane-1-carboxamide Openeye Name: (2S)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-methyl-5-oxo-1,4-diazepane-1-carboxamide CAS Name: (2S)-2-methyl-5-oxo-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1,4-diazepane-1-carboxamide IUPAC Name: (2S)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-2-methyl-5-oxo-1,4-diazepane-1-carboxamide Traditional Name: (2S)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-5-keto-2-methyl-1,4-diazepane-1-carboxamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(=O)CCN1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CNC(=O)CCN1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2S/c1-11-10-17-13(22)7-8-21(11)16(23)18-15-20-19-14(24-15)9-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,17,22)(H,18,20,23)/t11-/m0/s1