(2S)-2-[[6-(4-methylphenoxy)-1-(oxan-4-yl)benzimidazol-2-yl]methylamino]propanamide

Systemtic Name: (2S)-2-[[6-(4-methylphenoxy)-1-(oxan-4-yl)benzimidazol-2-yl]methylamino]propanamide Openeye Name: (2S)-2-[[6-(4-methylphenoxy)-1-tetrahydropyran-4-yl-benzimidazol-2-yl]methylamino]propanamide CAS Name: (2S)-2-[[6-(4-methylphenoxy)-1-(4-oxanyl)-2-benzimidazolyl]methylamino]propanamide IUPAC Name: (2S)-2-[[6-(4-methylphenoxy)-1-(oxan-4-yl)benzimidazol-2-yl]methylamino]propanamide Traditional Name: (2S)-2-[[6-(4-methylphenoxy)-1-tetrahydropyran-4-yl-benzimidazol-2-yl]methylamino]propionamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(N3C4CCOCC4)CNC(C)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(N3C4CCOCC4)CN[C@@H](C)C(=O)N

InChI

InChI=1S/C23H28N4O3/c1-15-3-5-18(6-4-15)30-19-7-8-20-21(13-19)27(17-9-11-29-12-10-17)22(26-20)14-25-16(2)23(24)28/h3-8,13,16-17,25H,9-12,14H2,1-2H3,(H2,24,28)/t16-/m0/s1