3-morpholin-4-yl-2-(2-nitrophenyl)sulfanyl-but-2-enenitrile

Systemtic Name: 3-morpholin-4-yl-2-(2-nitrophenyl)sulfanyl-but-2-enenitrile Openeye Name: 3-morpholino-2-(2-nitrophenyl)sulfanyl-but-2-enenitrile CAS Name: 3-(4-morpholinyl)-2-[(2-nitrophenyl)thio]-2-butenenitrile IUPAC Name: 3-morpholin-4-yl-2-(2-nitrophenyl)sulfanylbut-2-enenitrile Traditional Name: 3-morpholino-2-[(2-nitrophenyl)thio]but-2-enenitrile Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)SC1=CC=CC=C1[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CC(=C(C#N)SC1=CC=CC=C1[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C14H15N3O3S/c1-11(16-6-8-20-9-7-16)14(10-15)21-13-5-3-2-4-12(13)17(18)19/h2-5H,6-9H2,1H3