N-[C-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]morpholine-4-carbothioamide

Systemtic Name: N-[C-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]morpholine-4-carbothioamide Openeye Name: N-[C-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]morpholine-4-carbothioamide CAS Name: N-[(4-chlorophenyl)-[(4-nitrophenyl)methylimino]methyl]-4-morpholinecarbothioamide IUPAC Name: N-[C-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]carbonimidoyl]morpholine-4-carbothioamide Traditional Name: N-[C-(4-chlorophenyl)-N-(4-nitrobenzyl)carbonimidoyl]morpholine-4-carbothioamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)NC(=NCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C(=S)NC(=NCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN4O3S/c20-16-5-3-15(4-6-16)18(22-19(28)23-9-11-27-12-10-23)21-13-14-1-7-17(8-2-14)24(25)26/h1-8H,9-13H2,(H,21,22,28)