3-[[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide

Systemtic Name: 3-[[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide Openeye Name: 3-[[[(2R)-2-amino-3-sulfanyl-propyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide CAS Name: 3-[[[(2R)-2-amino-3-mercaptopropyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide IUPAC Name: 3-[[[(2R)-2-amino-3-sulfanylpropyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide Traditional Name: 3-[[[(2R)-2-amino-3-mercapto-propyl]amino]methyl]-N-(2,3-dimethylphenyl)benzamide Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC(=CC=C2)CNCC(CS)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC(=CC=C2)CNC[C@H](CS)N)C

InChI

InChI=1S/C19H25N3OS/c1-13-5-3-8-18(14(13)2)22-19(23)16-7-4-6-15(9-16)10-21-11-17(20)12-24/h3-9,17,21,24H,10-12,20H2,1-2H3,(H,22,23)/t17-/m1/s1