N-methyl-N-[(3-nitrophenyl)methyl]-2-(4-propan-2-ylphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-methyl-N-[(3-nitrophenyl)methyl]-2-(4-propan-2-ylphenyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-isopropylphenyl)-N-methyl-N-[(3-nitrophenyl)methyl]thiazole-4-carboxamide CAS Name: N-methyl-N-[(3-nitrophenyl)methyl]-2-(4-propan-2-ylphenyl)-4-thiazolecarboxamide IUPAC Name: N-methyl-N-[(3-nitrophenyl)methyl]-2-(4-propan-2-ylphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-methyl-N-(3-nitrobenzyl)-2-p-cumenyl-thiazole-4-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O3S/c1-14(2)16-7-9-17(10-8-16)20-22-19(13-28-20)21(25)23(3)12-15-5-4-6-18(11-15)24(26)27/h4-11,13-14H,12H2,1-3H3