3-[3-[5-[(1S)-1-azanylethyl]benzimidazol-1-yl]phenyl]-4-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[3-[5-[(1S)-1-azanylethyl]benzimidazol-1-yl]phenyl]-4-chloranyl-benzenecarbonitrile Openeye Name: 3-[3-[5-[(1S)-1-aminoethyl]benzimidazol-1-yl]phenyl]-4-chloro-benzonitrile CAS Name: 3-[3-[5-[(1S)-1-aminoethyl]-1-benzimidazolyl]phenyl]-4-chlorobenzonitrile IUPAC Name: 3-[3-[5-[(1S)-1-aminoethyl]benzimidazol-1-yl]phenyl]-4-chlorobenzonitrile Traditional Name: 3-[3-[5-[(1S)-1-aminoethyl]benzimidazol-1-yl]phenyl]-4-chloro-benzonitrile Formula: C22H17ClN4 MolecularWeight: 372.85018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)C4=C(C=CC(=C4)C#N)Cl)N

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)C4=C(C=CC(=C4)C#N)Cl)N

InChI

InChI=1S/C22H17ClN4/c1-14(25)16-6-8-22-21(11-16)26-13-27(22)18-4-2-3-17(10-18)19-9-15(12-24)5-7-20(19)23/h2-11,13-14H,25H2,1H3/t14-/m0/s1