N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)ethanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)acetamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)acetamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(2-nitrophenyl)acetamide Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O3S/c1-14-6-11-18-20(12-14)29-22(24-18)15-7-9-17(10-8-15)23-21(26)13-16-4-2-3-5-19(16)25(27)28/h2-12H,13H2,1H3,(H,23,26)