2-(4-chlorophenyl)sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(6-nitro-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C21H15ClN4O3S2 MolecularWeight: 470.9518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O3S2/c22-14-4-7-17(8-5-14)30-13-20(27)25(12-15-3-1-2-10-23-15)21-24-18-9-6-16(26(28)29)11-19(18)31-21/h1-11H,12-13H2