1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea CAS Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)thiourea Formula: C14H9N5O4S2 MolecularWeight: 375.38236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O4S2/c20-18(21)9-3-1-8(2-4-9)15-13(24)17-14-16-11-6-5-10(19(22)23)7-12(11)25-14/h1-7H,(H2,15,16,17,24)