4-chloranyl-3-nitro-N-pyrrolidin-1-ylcarbothioyl-benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-pyrrolidin-1-ylcarbothioyl-benzamide Openeye Name: 4-chloro-3-nitro-N-(pyrrolidine-1-carbothioyl)benzamide CAS Name: 4-chloro-3-nitro-N-[1-pyrrolidinyl(sulfanylidene)methyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-(pyrrolidine-1-carbothioyl)benzamide Traditional Name: 4-chloro-3-nitro-N-(pyrrolidine-1-carbothioyl)benzamide Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O3S/c13-9-4-3-8(7-10(9)16(18)19)11(17)14-12(20)15-5-1-2-6-15/h3-4,7H,1-2,5-6H2,(H,14,17,20)