2-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 2-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 2-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(2-pyridylmethyl)benzamide CAS Name: 2-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: 2-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 2-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(2-pyridylmethyl)benzamide Formula: C21H15ClN4O4S MolecularWeight: 454.8862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H15ClN4O4S/c1-30-15-6-8-18-19(11-15)31-21(24-18)25(12-13-4-2-3-9-23-13)20(27)16-10-14(26(28)29)5-7-17(16)22/h2-11H,12H2,1H3