N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-methyl-N-[(4-methylsulfanylphenyl)methyl]benzamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-methyl-N-[4-(methylthio)benzyl]benzamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC=C(C=C2)SC

InChI

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