N-[3-[2-(diethylamino)-1,3-thiazol-4-yl]phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[3-[2-(diethylamino)-1,3-thiazol-4-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[3-[2-(diethylamino)thiazol-4-yl]phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[3-[2-(diethylamino)-4-thiazolyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[3-[2-(diethylamino)-1,3-thiazol-4-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[3-[2-(diethylamino)thiazol-4-yl]phenyl]-4-methyl-3-nitro-benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3S/c1-4-24(5-2)21-23-18(13-29-21)15-7-6-8-17(11-15)22-20(26)16-10-9-14(3)19(12-16)25(27)28/h6-13H,4-5H2,1-3H3,(H,22,26)