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

Systemtic Name: 5-[4-[2-(3,4-dimethylphenyl)sulfanylethanoyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-2-methyl-oxazole-4-carbonitrile CAS Name: 5-[4-[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]-1-piperazinyl]-2-methyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[2-(3,4-dimethylphenyl)sulfanylacetyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[2-[(3,4-dimethylphenyl)thio]acetyl]piperazino]-2-methyl-oxazole-4-carbonitrile Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)N2CCN(CC2)C3=C(N=C(O3)C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)N2CCN(CC2)C3=C(N=C(O3)C)C#N)C

InChI

InChI=1S/C19H22N4O2S/c1-13-4-5-16(10-14(13)2)26-12-18(24)22-6-8-23(9-7-22)19-17(11-20)21-15(3)25-19/h4-5,10H,6-9,12H2,1-3H3