3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-methylphenyl)sulfanyl-benzamide

Systemtic Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-methylphenyl)sulfanyl-benzamide Openeye Name: 3-acetamido-N-[3-(diisobutylamino)propyl]-4-(p-tolylsulfanyl)benzamide CAS Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-[(4-methylphenyl)thio]benzamide IUPAC Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-methylphenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-[3-(diisobutylamino)propyl]-4-(p-tolylthio)benzamide Formula: C27H39N3O2S MolecularWeight: 469.68246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCCN(CC(C)C)CC(C)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCCN(CC(C)C)CC(C)C)NC(=O)C

InChI

InChI=1S/C27H39N3O2S/c1-19(2)17-30(18-20(3)4)15-7-14-28-27(32)23-10-13-26(25(16-23)29-22(6)31)33-24-11-8-21(5)9-12-24/h8-13,16,19-20H,7,14-15,17-18H2,1-6H3,(H,28,32)(H,29,31)