N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridylmethyl)benzamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-nitro-N-(2-pyridylmethyl)benzamide Formula: C21H15ClN4O3S MolecularWeight: 438.8868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN4O3S/c1-13-8-9-17(22)19-18(13)24-21(30-19)25(12-15-6-2-3-10-23-15)20(27)14-5-4-7-16(11-14)26(28)29/h2-11H,12H2,1H3