methyl 2-[[(morpholin-4-ylcarbothioylamino)-(4-nitrophenyl)methylidene]amino]ethanoate

Systemtic Name: methyl 2-[[(morpholin-4-ylcarbothioylamino)-(4-nitrophenyl)methylidene]amino]ethanoate Openeye Name: methyl 2-[[(morpholine-4-carbothioylamino)-(4-nitrophenyl)methylene]amino]acetate CAS Name: 2-[[[[4-morpholinyl(sulfanylidene)methyl]amino]-(4-nitrophenyl)methylidene]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(morpholine-4-carbothioylamino)-(4-nitrophenyl)methylidene]amino]acetate Traditional Name: 2-[[(morpholine-4-carbothioylamino)-(4-nitrophenyl)methylene]amino]acetic acid methyl ester Formula: C15H18N4O5S MolecularWeight: 366.39222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O5S/c1-23-13(20)10-16-14(11-2-4-12(5-3-11)19(21)22)17-15(25)18-6-8-24-9-7-18/h2-5H,6-10H2,1H3,(H,16,17,25)