N-(5-chloranyl-2-methoxy-phenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C18H14ClN3O4S2 MolecularWeight: 435.90446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN3O4S2/c1-10-9-27-18(20-10)28-16-6-3-11(7-14(16)22(24)25)17(23)21-13-8-12(19)4-5-15(13)26-2/h3-9H,1-2H3,(H,21,23)