2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-[[3-[(3,4-dimethylphenyl)thio]-1-oxopropyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 2-[3-[(3,4-dimethylphenyl)thio]propanoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=CC=C2C(=O)NCC3CCCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=CC=C2C(=O)NCC3CCCO3)C

InChI

InChI=1S/C23H28N2O3S/c1-16-9-10-19(14-17(16)2)29-13-11-22(26)25-21-8-4-3-7-20(21)23(27)24-15-18-6-5-12-28-18/h3-4,7-10,14,18H,5-6,11-13,15H2,1-2H3,(H,24,27)(H,25,26)