N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide

Systemtic Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide Openeye Name: N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide CAS Name: N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-4-(dimethylamino)-3-nitrobenzamide IUPAC Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-(dimethylamino)-3-nitrobenzamide Traditional Name: N-[5-(3-chlorobenzyl)thiazol-2-yl]-4-(dimethylamino)-3-nitro-benzamide Formula: C19H17ClN4O3S MolecularWeight: 416.88128

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN4O3S/c1-23(2)16-7-6-13(10-17(16)24(26)27)18(25)22-19-21-11-15(28-19)9-12-4-3-5-14(20)8-12/h3-8,10-11H,9H2,1-2H3,(H,21,22,25)