N,N-diethyl-2,2-dimethyl-6-nitro-chromene-4-carbothioamide

Systemtic Name: N,N-diethyl-2,2-dimethyl-6-nitro-chromene-4-carbothioamide Openeye Name: N,N-diethyl-2,2-dimethyl-6-nitro-chromene-4-carbothioamide CAS Name: N,N-diethyl-2,2-dimethyl-6-nitro-1-benzopyran-4-carbothioamide IUPAC Name: N,N-diethyl-2,2-dimethyl-6-nitrochromene-4-carbothioamide Traditional Name: N,N-diethyl-2,2-dimethyl-6-nitro-chromene-4-carbothioamide Formula: C16H20N2O3S MolecularWeight: 320.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)C1=CC(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C

Isomeric SMILES

CCN(CC)C(=S)C1=CC(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C

InChI

InChI=1S/C16H20N2O3S/c1-5-17(6-2)15(22)13-10-16(3,4)21-14-8-7-11(18(19)20)9-12(13)14/h7-10H,5-6H2,1-4H3