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

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-chloranyl-5-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-N-(2-pyridylmethyl)benzamide Formula: C20H12BrClN4O3S MolecularWeight: 503.75628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H12BrClN4O3S/c21-12-4-7-17-18(9-12)30-20(24-17)25(11-13-3-1-2-8-23-13)19(27)15-10-14(26(28)29)5-6-16(15)22/h1-10H,11H2