N-(6-azanyl-1,3-benzothiazol-2-yl)-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-(6-azanyl-1,3-benzothiazol-2-yl)-2-chloranyl-5-nitro-benzamide Openeye Name: N-(6-amino-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-benzamide CAS Name: N-(6-amino-1,3-benzothiazol-2-yl)-2-chloro-5-nitrobenzamide IUPAC Name: N-(6-amino-1,3-benzothiazol-2-yl)-2-chloro-5-nitrobenzamide Traditional Name: N-(6-amino-1,3-benzothiazol-2-yl)-2-chloro-5-nitro-benzamide Formula: C14H9ClN4O3S MolecularWeight: 348.76426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC2=C(C=C1N)SC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H9ClN4O3S/c15-10-3-2-8(19(21)22)6-9(10)13(20)18-14-17-11-4-1-7(16)5-12(11)23-14/h1-6H,16H2,(H,17,18,20)