3,3-bis(dimethylamino)-2-nitro-N-phenyl-prop-2-enethioamide

Systemtic Name: 3,3-bis(dimethylamino)-2-nitro-N-phenyl-prop-2-enethioamide Openeye Name: 3,3-bis(dimethylamino)-2-nitro-N-phenyl-prop-2-enethioamide CAS Name: 3,3-bis(dimethylamino)-2-nitro-N-phenyl-2-propenethioamide IUPAC Name: 3,3-bis(dimethylamino)-2-nitro-N-phenylprop-2-enethioamide Traditional Name: 3,3-bis(dimethylamino)-2-nitro-N-phenyl-thioacrylamide Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=C(C(=S)NC1=CC=CC=C1)[N+](=O)[O-])N(C)C

Isomeric SMILES

CN(C)C(=C(C(=S)NC1=CC=CC=C1)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C13H18N4O2S/c1-15(2)13(16(3)4)11(17(18)19)12(20)14-10-8-6-5-7-9-10/h5-9H,1-4H3,(H,14,20)