4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-4-oxidanylidene-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzenecarbonitrile

Systemtic Name: 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-4-oxidanylidene-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzenecarbonitrile Openeye Name: 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-4-oxo-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzonitrile CAS Name: 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-4-oxo-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzonitrile IUPAC Name: 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-4-oxo-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzonitrile Traditional Name: 4-[4-keto-3-(4-mesylbenzyl)-1-methyl-2-prop-1-ynyl-2,3-dihydroquinolin-6-yl]benzonitrile Formula: C28H24N2O3S MolecularWeight: 468.56676

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1C(C(=O)C2=C(N1C)C=CC(=C2)C3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC#CC1C(C(=O)C2=C(N1C)C=CC(=C2)C3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C28H24N2O3S/c1-4-5-26-24(16-19-8-13-23(14-9-19)34(3,32)33)28(31)25-17-22(12-15-27(25)30(26)2)21-10-6-20(18-29)7-11-21/h6-15,17,24,26H,16H2,1-3H3