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

Systemtic Name: N-(3-aminocarbonylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-(3-carbamoylphenyl)-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-(3-carbamoylphenyl)-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-(3-carbamoylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-(3-carbamoylphenyl)-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C18H14N4O4S2 MolecularWeight: 414.45816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O4S2/c1-10-9-27-18(20-10)28-15-6-5-12(8-14(15)22(25)26)17(24)21-13-4-2-3-11(7-13)16(19)23/h2-9H,1H3,(H2,19,23)(H,21,24)