4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methylimidazol-4-yl)-phenyl-methyl]quinolin-2-one

Systemtic Name: 4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methylimidazol-4-yl)-phenyl-methyl]quinolin-2-one Openeye Name: 4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methylimidazol-4-yl)-phenyl-methyl]quinolin-2-one CAS Name: 4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methyl-4-imidazolyl)-phenylmethyl]-2-quinolinone IUPAC Name: 4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methylimidazol-4-yl)-phenylmethyl]quinolin-2-one Traditional Name: 4-(3-ethynylphenyl)-1-methyl-6-[(S)-(3-methylimidazol-4-yl)-phenyl-methyl]carbostyril Formula: C29H23N3O MolecularWeight: 429.51242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=CC=C2)C3=CC4=C(C=C3)N(C(=O)C=C4C5=CC=CC(=C5)C#C)C

Isomeric SMILES

CN1C=NC=C1[C@@H](C2=CC=CC=C2)C3=CC4=C(C=C3)N(C(=O)C=C4C5=CC=CC(=C5)C#C)C

InChI

InChI=1S/C29H23N3O/c1-4-20-9-8-12-22(15-20)24-17-28(33)32(3)26-14-13-23(16-25(24)26)29(21-10-6-5-7-11-21)27-18-30-19-31(27)2/h1,5-19,29H,2-3H3/t29-/m0/s1