N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-(4-propan-2-ylphenoxy)butanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-(4-propan-2-ylphenoxy)butanamide Openeye Name: 4-(4-isopropylphenoxy)-N-[4-(3-nitrophenyl)thiazol-2-yl]butanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-4-(4-propan-2-ylphenoxy)butanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-(4-propan-2-ylphenoxy)butanamide Traditional Name: 4-(4-isopropylphenoxy)-N-[4-(3-nitrophenyl)thiazol-2-yl]butyramide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O4S/c1-15(2)16-8-10-19(11-9-16)29-12-4-7-21(26)24-22-23-20(14-30-22)17-5-3-6-18(13-17)25(27)28/h3,5-6,8-11,13-15H,4,7,12H2,1-2H3,(H,23,24,26)