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

Systemtic Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[5-(3-chlorobenzyl)thiazol-2-yl]-2-methyl-3-nitro-benzamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H14ClN3O3S/c1-11-15(6-3-7-16(11)22(24)25)17(23)21-18-20-10-14(26-18)9-12-4-2-5-13(19)8-12/h2-8,10H,9H2,1H3,(H,20,21,23)