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

Systemtic Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-(2-methoxyethyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCNC(=S)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O3S/c1-21-11-6-15-14(22)17-9-7-16(8-10-17)12-2-4-13(5-3-12)18(19)20/h2-5H,6-11H2,1H3,(H,15,22)