N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(2-pyridylmethyl)benzamide CAS Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(2-pyridylmethyl)benzamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H18N4O3S/c1-14-11-15(2)20-19(12-14)24-22(30-20)25(13-17-5-3-4-10-23-17)21(27)16-6-8-18(9-7-16)26(28)29/h3-12H,13H2,1-2H3