N-[(4-chlorophenyl)methyl]-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-[(4-chlorophenyl)methyl]-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(4-chlorobenzyl)-N-methyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C17H14ClN3O3S2 MolecularWeight: 407.89436

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Cl)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)Cl)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O3S2/c1-20(9-11-2-4-12(18)5-3-11)16(22)10-25-17-19-14-7-6-13(21(23)24)8-15(14)26-17/h2-8H,9-10H2,1H3