4-[2-(4-chloranylphenoxy)ethyl]-N-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[2-(4-chloranylphenoxy)ethyl]-N-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C19H21ClN4O3S MolecularWeight: 420.91304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O3S/c20-15-1-7-18(8-2-15)27-14-13-22-9-11-23(12-10-22)19(28)21-16-3-5-17(6-4-16)24(25)26/h1-8H,9-14H2,(H,21,28)