N-(4-nitrophenyl)-2-phenyl-6H-5,1,3-benzothiadiazocin-4-amine

Systemtic Name: N-(4-nitrophenyl)-2-phenyl-6H-5,1,3-benzothiadiazocin-4-amine Openeye Name: N-(4-nitrophenyl)-2-phenyl-6H-5,1,3-benzothiadiazocin-4-amine CAS Name: N-(4-nitrophenyl)-2-phenyl-6H-5,1,3-benzothiadiazocin-4-amine IUPAC Name: N-(4-nitrophenyl)-2-phenyl-6H-5,1,3-benzothiadiazocin-4-amine Traditional Name: (4-nitrophenyl)-(2-phenyl-6H-5,1,3-benzothiadiazocin-4-yl)amine Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N=C(N=C(S1)NC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2N=C(N=C(S1)NC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O2S/c26-25(27)18-12-10-17(11-13-18)22-21-24-20(15-6-2-1-3-7-15)23-19-9-5-4-8-16(19)14-28-21/h1-13H,14H2,(H,22,23,24)