N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-4-(phenylsulfanylmethyl)benzamide

Systemtic Name: N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-4-(phenylsulfanylmethyl)benzamide Openeye Name: N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-4-(phenylsulfanylmethyl)benzamide CAS Name: N-[2-methyl-5-[(2-methyl-1-oxopropyl)amino]phenyl]-4-[(phenylthio)methyl]benzamide IUPAC Name: N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-4-(phenylsulfanylmethyl)benzamide Traditional Name: N-[5-(isobutyrylamino)-2-methyl-phenyl]-4-[(phenylthio)methyl]benzamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CC=C(C=C2)CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=CC=C(C=C2)CSC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O2S/c1-17(2)24(28)26-21-14-9-18(3)23(15-21)27-25(29)20-12-10-19(11-13-20)16-30-22-7-5-4-6-8-22/h4-15,17H,16H2,1-3H3,(H,26,28)(H,27,29)