N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-nitro-benzamide Openeye Name: 2-nitro-N-[4-(4-sec-butylphenyl)thiazol-2-yl]benzamide CAS Name: N-[4-(4-butan-2-ylphenyl)-2-thiazolyl]-2-nitrobenzamide IUPAC Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2-nitrobenzamide Traditional Name: 2-nitro-N-[4-(4-sec-butylphenyl)thiazol-2-yl]benzamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S/c1-3-13(2)14-8-10-15(11-9-14)17-12-27-20(21-17)22-19(24)16-6-4-5-7-18(16)23(25)26/h4-13H,3H2,1-2H3,(H,21,22,24)