4-(2-nitrophenyl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-nitrophenyl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-nitrophenyl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(2-nitrophenyl)-N-(4-phenoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2-nitrophenyl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-nitrophenyl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H22N4O3S/c28-27(29)22-9-5-4-8-21(22)25-14-16-26(17-15-25)23(31)24-18-10-12-20(13-11-18)30-19-6-2-1-3-7-19/h1-13H,14-17H2,(H,24,31)