N-(2,6-dimethylphenyl)-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxo-ethyl]sulfanyl-butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]thio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]sulfanylbutanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[2-keto-2-[2-(3-methylphenoxy)ethylamino]ethyl]thio]butyramide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CSCCCC(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CSCCCC(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C23H30N2O3S/c1-17-7-4-10-20(15-17)28-13-12-24-22(27)16-29-14-6-11-21(26)25-23-18(2)8-5-9-19(23)3/h4-5,7-10,15H,6,11-14,16H2,1-3H3,(H,24,27)(H,25,26)