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

Systemtic Name: 1-(3,4-dichlorophenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3,4-dichlorophenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(3,4-dichlorophenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3,4-dichlorophenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3,4-dichlorophenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Formula: C14H8Cl2N4O2S2 MolecularWeight: 399.27492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8Cl2N4O2S2/c15-9-3-1-7(5-10(9)16)17-13(23)19-14-18-11-4-2-8(20(21)22)6-12(11)24-14/h1-6H,(H2,17,18,19,23)