N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCSCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H26ClN3O2S/c1-15(2)25-21(27)24-13-16-3-7-18(8-4-16)20(26)23-11-12-28-14-17-5-9-19(22)10-6-17/h3-10,15H,11-14H2,1-2H3,(H,23,26)(H2,24,25,27)