N'-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)ethane-1,2-diamine

Systemtic Name: N'-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)ethane-1,2-diamine Openeye Name: N'-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)ethane-1,2-diamine CAS Name: N'-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)ethane-1,2-diamine IUPAC Name: N'-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)ethane-1,2-diamine Traditional Name: 1,3-benzothiazol-2-yl-[2-(4-nitroanilino)ethyl]amine Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O2S/c20-19(21)12-7-5-11(6-8-12)16-9-10-17-15-18-13-3-1-2-4-14(13)22-15/h1-8,16H,9-10H2,(H,17,18)