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

Systemtic Name: N-[(2S)-1-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butan-2-yl]-1-phenyl-cyclopentane-1-carboxamide Openeye Name: N-[(1S)-1-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]propyl]-1-phenyl-cyclopentanecarboxamide CAS Name: N-[(2S)-1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]-1-phenyl-1-cyclopentanecarboxamide IUPAC Name: N-[(2S)-1-(4-oxo-1,2,3-benzotriazin-3-yl)butan-2-yl]-1-phenylcyclopentane-1-carboxamide Traditional Name: N-[(1S)-1-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]propyl]-1-phenyl-cyclopentanecarboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)C3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC[C@@H](CN1C(=O)C2=CC=CC=C2N=N1)NC(=O)C3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c1-2-18(16-27-21(28)19-12-6-7-13-20(19)25-26-27)24-22(29)23(14-8-9-15-23)17-10-4-3-5-11-17/h3-7,10-13,18H,2,8-9,14-16H2,1H3,(H,24,29)/t18-/m0/s1