2-[(6-azanyl-1,3-benzoxazol-2-yl)sulfanyl]-N-[3-[(3,4-dichlorophenyl)methyl-methyl-amino]propyl]ethanamide

Systemtic Name: 2-[(6-azanyl-1,3-benzoxazol-2-yl)sulfanyl]-N-[3-[(3,4-dichlorophenyl)methyl-methyl-amino]propyl]ethanamide Openeye Name: 2-[(6-amino-1,3-benzoxazol-2-yl)sulfanyl]-N-[3-[(3,4-dichlorophenyl)methyl-methyl-amino]propyl]acetamide CAS Name: 2-[(6-amino-1,3-benzoxazol-2-yl)thio]-N-[3-[(3,4-dichlorophenyl)methyl-methylamino]propyl]acetamide IUPAC Name: 2-[(6-amino-1,3-benzoxazol-2-yl)sulfanyl]-N-[3-[(3,4-dichlorophenyl)methyl-methylamino]propyl]acetamide Traditional Name: 2-[(6-amino-1,3-benzoxazol-2-yl)thio]-N-[3-[(3,4-dichlorobenzyl)-methyl-amino]propyl]acetamide Formula: C20H22Cl2N4O2S MolecularWeight: 453.38528

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CSC1=NC2=C(O1)C=C(C=C2)N)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CN(CCCNC(=O)CSC1=NC2=C(O1)C=C(C=C2)N)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N4O2S/c1-26(11-13-3-5-15(21)16(22)9-13)8-2-7-24-19(27)12-29-20-25-17-6-4-14(23)10-18(17)28-20/h3-6,9-10H,2,7-8,11-12,23H2,1H3,(H,24,27)