N1,N3-bis(1,3-benzothiazol-2-yl)-4,6-dinitro-benzene-1,3-diamine

Systemtic Name: N1,N3-bis(1,3-benzothiazol-2-yl)-4,6-dinitro-benzene-1,3-diamine Openeye Name: N1,N3-bis(1,3-benzothiazol-2-yl)-4,6-dinitro-benzene-1,3-diamine CAS Name: N1,N3-bis(1,3-benzothiazol-2-yl)-4,6-dinitrobenzene-1,3-diamine IUPAC Name: 1-N,3-N-bis(1,3-benzothiazol-2-yl)-4,6-dinitrobenzene-1,3-diamine Traditional Name: 1,3-benzothiazol-2-yl-[5-(1,3-benzothiazol-2-ylamino)-2,4-dinitro-phenyl]amine Formula: C20H12N6O4S2 MolecularWeight: 464.47708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H12N6O4S2/c27-25(28)15-10-16(26(29)30)14(24-20-22-12-6-2-4-8-18(12)32-20)9-13(15)23-19-21-11-5-1-3-7-17(11)31-19/h1-10H,(H,21,23)(H,22,24)