N-[3-[1-[2-(3,4-dimethylphenyl)sulfanylethylcarbamoylamino]ethyl]phenyl]ethanamide

Systemtic Name: N-[3-[1-[2-(3,4-dimethylphenyl)sulfanylethylcarbamoylamino]ethyl]phenyl]ethanamide Openeye Name: N-[3-[1-[2-(3,4-dimethylphenyl)sulfanylethylcarbamoylamino]ethyl]phenyl]acetamide CAS Name: N-[3-[1-[[[2-[(3,4-dimethylphenyl)thio]ethylamino]-oxomethyl]amino]ethyl]phenyl]acetamide IUPAC Name: N-[3-[1-[2-(3,4-dimethylphenyl)sulfanylethylcarbamoylamino]ethyl]phenyl]acetamide Traditional Name: N-[3-[1-[2-[(3,4-dimethylphenyl)thio]ethylcarbamoylamino]ethyl]phenyl]acetamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)NC(C)C2=CC(=CC=C2)NC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)NC(C)C2=CC(=CC=C2)NC(=O)C)C

InChI

InChI=1S/C21H27N3O2S/c1-14-8-9-20(12-15(14)2)27-11-10-22-21(26)23-16(3)18-6-5-7-19(13-18)24-17(4)25/h5-9,12-13,16H,10-11H2,1-4H3,(H,24,25)(H2,22,23,26)