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

Systemtic Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Openeye Name: 4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]benzamide CAS Name: 4-[(4-methyl-2-thiazolyl)thio]-3-nitro-N-[3-(2-oxolanylmethoxy)phenyl]benzamide IUPAC Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Traditional Name: 4-[(4-methylthiazol-2-yl)thio]-3-nitro-N-[3-(tetrahydrofurfuryloxy)phenyl]benzamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)OCC4CCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)OCC4CCCO4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O5S2/c1-14-13-31-22(23-14)32-20-8-7-15(10-19(20)25(27)28)21(26)24-16-4-2-5-17(11-16)30-12-18-6-3-9-29-18/h2,4-5,7-8,10-11,13,18H,3,6,9,12H2,1H3,(H,24,26)