4-[2-[3-(3,5-dimethylphenoxy)propylsulfanyl]ethanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[2-[3-(3,5-dimethylphenoxy)propylsulfanyl]ethanoylamino]-N-methyl-benzamide Openeye Name: 4-[[2-[3-(3,5-dimethylphenoxy)propylsulfanyl]acetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-[3-(3,5-dimethylphenoxy)propylthio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-[3-(3,5-dimethylphenoxy)propylsulfanyl]acetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-[3-(3,5-dimethylphenoxy)propylthio]acetyl]amino]-N-methyl-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSCC(=O)NC2=CC=C(C=C2)C(=O)NC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSCC(=O)NC2=CC=C(C=C2)C(=O)NC)C

InChI

InChI=1S/C21H26N2O3S/c1-15-11-16(2)13-19(12-15)26-9-4-10-27-14-20(24)23-18-7-5-17(6-8-18)21(25)22-3/h5-8,11-13H,4,9-10,14H2,1-3H3,(H,22,25)(H,23,24)