3-[(4-chlorophenyl)-(1H-imidazol-2-ylmethyl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 3-[(4-chlorophenyl)-(1H-imidazol-2-ylmethyl)amino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-[4-chloro-N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-[4-chloro-N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-[4-chloro-N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-[4-chloro-N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C22H21ClN4O MolecularWeight: 392.88134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1(C(CC2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H21ClN4O/c1-22(2)20(12-16-11-15(13-24)3-8-19(16)28-22)27(14-21-25-9-10-26-21)18-6-4-17(23)5-7-18/h3-11,20H,12,14H2,1-2H3,(H,25,26)