2-methyl-5-[4-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-methyl-5-[4-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-methyl-5-[4-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-methyl-5-[4-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-methyl-5-[4-[2-(4-methylquinolin-2-yl)sulfanylacetyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-methyl-5-[4-[2-[(4-methyl-2-quinolyl)thio]acetyl]piperazino]oxazole-4-carbonitrile Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=C(N=C(O4)C)C#N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=C(N=C(O4)C)C#N

InChI

InChI=1S/C21H21N5O2S/c1-14-11-19(24-17-6-4-3-5-16(14)17)29-13-20(27)25-7-9-26(10-8-25)21-18(12-22)23-15(2)28-21/h3-6,11H,7-10,13H2,1-2H3