2-chloranyl-4-nitro-N-(3-phenylmethoxyphenyl)benzenecarbothioamide

Systemtic Name: 2-chloranyl-4-nitro-N-(3-phenylmethoxyphenyl)benzenecarbothioamide Openeye Name: N-(3-benzyloxyphenyl)-2-chloro-4-nitro-benzenecarbothioamide CAS Name: 2-chloro-4-nitro-N-(3-phenylmethoxyphenyl)benzenecarbothioamide IUPAC Name: 2-chloro-4-nitro-N-(3-phenylmethoxyphenyl)benzenecarbothioamide Traditional Name: N-(3-benzoxyphenyl)-2-chloro-4-nitro-thiobenzamide Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H15ClN2O3S/c21-19-12-16(23(24)25)9-10-18(19)20(27)22-15-7-4-8-17(11-15)26-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,27)