N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloro-3-nitro-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-chloro-3-nitro-benzamide Formula: C20H12ClN3O3S MolecularWeight: 409.84558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H12ClN3O3S/c21-15-10-7-13(11-17(15)24(26)27)19(25)22-14-8-5-12(6-9-14)20-23-16-3-1-2-4-18(16)28-20/h1-11H,(H,22,25)