1-[(E)-(2-chlorophenyl)methylideneamino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-[(E)-(2-chlorophenyl)methylideneamino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-[(E)-(2-chlorophenyl)methyleneamino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-[(E)-(2-chlorophenyl)methylideneamino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-[(E)-(2-chlorophenyl)methylideneamino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-[(E)-(2-chlorobenzylidene)amino]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Formula: C15H10ClN5O2S2 MolecularWeight: 391.8552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClN5O2S2/c16-11-4-2-1-3-9(11)8-17-20-14(24)19-15-18-12-6-5-10(21(22)23)7-13(12)25-15/h1-8H,(H2,18,19,20,24)/b17-8+