N-[(1S)-1-(6-chloranyl-1H-benzimidazol-2-yl)ethyl]-3-methyl-4-(2-oxidanylidene-1,3-oxazepan-3-yl)benzamide

Systemtic Name: N-[(1S)-1-(6-chloranyl-1H-benzimidazol-2-yl)ethyl]-3-methyl-4-(2-oxidanylidene-1,3-oxazepan-3-yl)benzamide Openeye Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-3-methyl-4-(2-oxo-1,3-oxazepan-3-yl)benzamide CAS Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-3-methyl-4-(2-oxo-1,3-oxazepan-3-yl)benzamide IUPAC Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-3-methyl-4-(2-oxo-1,3-oxazepan-3-yl)benzamide Traditional Name: N-[(1S)-1-(6-chloro-1H-benzimidazol-2-yl)ethyl]-4-(2-keto-1,3-oxazepan-3-yl)-3-methyl-benzamide Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(C)C2=NC3=C(N2)C=C(C=C3)Cl)N4CCCCOC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N[C@@H](C)C2=NC3=C(N2)C=C(C=C3)Cl)N4CCCCOC4=O

InChI

InChI=1S/C22H23ClN4O3/c1-13-11-15(5-8-19(13)27-9-3-4-10-30-22(27)29)21(28)24-14(2)20-25-17-7-6-16(23)12-18(17)26-20/h5-8,11-12,14H,3-4,9-10H2,1-2H3,(H,24,28)(H,25,26)/t14-/m0/s1