N-(2-methoxy-4-nitro-phenyl)morpholine-4-carbothioamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)morpholine-4-carbothioamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)morpholine-4-carbothioamide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-morpholinecarbothioamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)morpholine-4-carbothioamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)morpholine-4-carbothioamide Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCOCC2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCOCC2

InChI

InChI=1S/C12H15N3O4S/c1-18-11-8-9(15(16)17)2-3-10(11)13-12(20)14-4-6-19-7-5-14/h2-3,8H,4-7H2,1H3,(H,13,20)