N-[(1R,2S)-2-azanylcyclohexyl]-7-oxidanylidene-benzo[e]perimidine-4-carboxamide

Systemtic Name: N-[(1R,2S)-2-azanylcyclohexyl]-7-oxidanylidene-benzo[e]perimidine-4-carboxamide Openeye Name: N-[(1R,2S)-2-aminocyclohexyl]-7-oxo-benzo[e]perimidine-4-carboxamide CAS Name: N-[(1R,2S)-2-aminocyclohexyl]-7-oxo-4-benzo[e]perimidinecarboxamide IUPAC Name: N-[(1R,2S)-2-aminocyclohexyl]-7-oxobenzo[e]perimidine-4-carboxamide Traditional Name: N-[(1R,2S)-2-aminocyclohexyl]-7-keto-benzo[e]perimidine-4-carboxamide Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC(=O)C2=C3C4=C(C=C2)C(=O)C5=CC=CC=C5C4=NC=N3

Isomeric SMILES

C1CC[C@H]([C@H](C1)N)NC(=O)C2=C3C4=C(C=C2)C(=O)C5=CC=CC=C5C4=NC=N3

InChI

InChI=1S/C22H20N4O2/c23-16-7-3-4-8-17(16)26-22(28)15-10-9-14-18-19(24-11-25-20(15)18)12-5-1-2-6-13(12)21(14)27/h1-2,5-6,9-11,16-17H,3-4,7-8,23H2,(H,26,28)/t16-,17+/m0/s1