N-[(2S)-1-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]propyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]propyl]thiophene-2-carboxamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)C3=CC=CS3

Isomeric SMILES

CC[C@@H](CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)C3=CC=CS3

InChI

InChI=1S/C16H16N4O2S/c1-2-11(17-15(21)14-8-5-9-23-14)10-20-16(22)12-6-3-4-7-13(12)18-19-20/h3-9,11H,2,10H2,1H3,(H,17,21)/t11-/m0/s1