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

Systemtic Name: N-[4-(2-methoxyethoxy)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-[4-(2-methoxyethoxy)phenyl]-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-[4-(2-methoxyethoxy)phenyl]-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-[4-(2-methoxyethoxy)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-[4-(2-methoxyethoxy)phenyl]-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O5S2/c1-13-12-29-20(21-13)30-18-8-3-14(11-17(18)23(25)26)19(24)22-15-4-6-16(7-5-15)28-10-9-27-2/h3-8,11-12H,9-10H2,1-2H3,(H,22,24)