N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide Formula: C20H17N5O4S MolecularWeight: 423.44508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O4S/c1-12-9-18(25(27)28)23-24(12)11-13-5-3-4-6-15(13)19(26)22-20-21-16-8-7-14(29-2)10-17(16)30-20/h3-10H,11H2,1-2H3,(H,21,22,26)