N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-(4-isopropylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)acetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenyl)acetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-p-cumenyl-acetamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-11(2)13-5-3-12(4-6-13)9-17(22)20-18-19-15-8-7-14(21(23)24)10-16(15)25-18/h3-8,10-11H,9H2,1-2H3,(H,19,20,22)