N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-2-(3-methyl-4-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-2-(3-methyl-4-propan-2-yl-phenoxy)ethanamide Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]acetamide CAS Name: N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide IUPAC Name: N-[(2-methyl-5-nitrophenyl)carbamothioyl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]acetamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)COC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)COC2=CC(=C(C=C2)C(C)C)C

InChI

InChI=1S/C20H23N3O4S/c1-12(2)17-8-7-16(9-14(17)4)27-11-19(24)22-20(28)21-18-10-15(23(25)26)6-5-13(18)3/h5-10,12H,11H2,1-4H3,(H2,21,22,24,28)