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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide Openeye Name: 3-(4-isopropylphenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-3-p-cumenyl-propionamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S/c1-12(2)14-6-3-13(4-7-14)5-10-18(23)21-19-20-16-9-8-15(22(24)25)11-17(16)26-19/h3-4,6-9,11-12H,5,10H2,1-2H3,(H,20,21,23)